Compound Identification
SMILES
COC1=C(CSC2=NN=C(N2C)C2=CC=C(N)C=C2)C=C(C=C1)[N+]([O-])=O
InChIKey
InChIKey=NTCJDVDCKQUTBB-UHFFFAOYSA-N
Formula
C17H17N5O3S
Mass
371.42
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Benzenoids
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Class
Benzene and substituted derivatives
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Subclass
Nitrobenzenes
- Level 5 Nitrophenyl ethers
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Subclass
Nitrobenzenes
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Class
Benzene and substituted derivatives
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Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Nitrobenzenes
Intermediate Tree Nodes
Not available
Direct Parent
Nitrophenyl ethers
Alternative Parents
Phenyl-1,2,4-triazoles Methoxyanilines Anisoles Methoxybenzenes Nitroaromatic compounds Phenoxy compounds Alkyl aryl ethers Alkylarylthioethers Heteroaromatic compounds Organic oxoazanium compounds Sulfenyl compounds Azacyclic compounds Propargyl-type 1,3-dipolar organic compounds Organic oxides Hydrocarbon derivatives Organopnictogen compounds Primary amines
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Phenyl-1,2,4-triazole - Phenyltriazole - Nitrophenyl ether - Methoxyaniline - Phenoxy compound - Aniline or substituted anilines - Aryl thioether - Methoxybenzene - Phenol ether - Anisole - Nitroaromatic compound - Alkyl aryl ether - Alkylarylthioether - Triazole - Heteroaromatic compound - Azole - 1,2,4-triazole - Organic nitro compound - C-nitro compound - Ether - Organic oxoazanium - Thioether - Azacycle - Organoheterocyclic compound - Sulfenyl compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organosulfur compound - Organooxygen compound - Hydrocarbon derivative - Primary amine - Organic oxygen compound - Organopnictogen compound - Organic nitrogen compound - Organic oxide - Amine - Organonitrogen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as nitrophenyl ethers. These are aromatic compounds containing a nitrobenzene moiety that carries an ether group on the benzene ring.
External Descriptors
Not available