Compound Identification
SMILES
COC1=CC=C(C=C2N=C(SCN3N=NC4=CC=CC=C4C3=O)N(C2=O)C2=CC=C(OC(F)F)C=C2)C=C1
InChIKey
InChIKey=BIACMPYOHMVXFB-UHFFFAOYSA-N
Formula
C26H19F2N5O4S
Mass
535.53
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
-
Superclass
Organic acids and derivatives
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Class
Carboxylic acids and derivatives
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Subclass
Amino acids, peptides, and analogues
- Level 5 Amino acids and derivatives
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Subclass
Amino acids, peptides, and analogues
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Class
Carboxylic acids and derivatives
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Superclass
Organic acids and derivatives
Kingdom
Organic compounds
Superclass
Organic acids and derivatives
Class
Carboxylic acids and derivatives
Subclass
Amino acids, peptides, and analogues
Intermediate Tree Nodes
Amino acids and derivatives
Direct Parent
Alpha amino acids and derivatives
Alternative Parents
Benzo-1,2,3-triazines Phenoxy compounds Anisoles Methoxybenzenes Triazinones Alkyl aryl ethers 1,2,3-triazines Imidazolinones Heteroaromatic compounds Lactams Isothioureas Azacyclic compounds Sulfenyl compounds Propargyl-type 1,3-dipolar organic compounds Hydrocarbon derivatives Organic oxides Carbonyl compounds Organofluorides Organonitrogen compounds Alkyl fluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-amino acid or derivatives - Benzo-1,2,3-triazine - Anisole - Phenol ether - Methoxybenzene - Phenoxy compound - Alkyl aryl ether - Triazinone - 1,2,3-triazine - Imidazolinone - Benzenoid - Monocyclic benzene moiety - Triazine - Heteroaromatic compound - 2-imidazoline - Lactam - Isothiourea - Sulfenyl compound - Ether - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organoheterocyclic compound - Azacycle - Organic nitrogen compound - Organohalogen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Carbonyl group - Alkyl fluoride - Alkyl halide - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as alpha amino acids and derivatives. These are amino acids in which the amino group is attached to the carbon atom immediately adjacent to the carboxylate group (alpha carbon), or a derivative thereof.
External Descriptors
Not available