Compound Identification
SMILES
COC1=C(OCCC(=O)NC2=CN(C)C(=C2)C(=O)NC2=CN(C)C(=C2)C(=O)NC2=CN(C)C(=C2)C(=O)NC2=CN(C)C(=C2)C(=O)NCCC(N)=N)C=C2N=C[C@@H]3CCCN3C(=O)C2=C1
InChIKey
InChIKey=NLZLUCLDVQILGP-NDEPHWFRSA-N
Formula
C43H49N13O8
Mass
875.948
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Benzodiazepines
- Subclass 1,4-benzodiazepines
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Class
Benzodiazepines
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzodiazepines
Subclass
1,4-benzodiazepines
Intermediate Tree Nodes
Not available
Direct Parent
Pyrrolo[2,1-c][1,4]benzodiazepines
Alternative Parents
Pyrrole carboxamides 2-heteroaryl carboxamides Anisoles N-arylamides Alkyl aryl ethers N-methylpyrroles Tertiary carboxylic acid amides Pyrrolidines Heteroaromatic compounds Secondary carboxylic acid amides Lactams Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Carboxamidines Carboximidamides Carbonyl compounds Organic oxides Organopnictogen compounds Imines Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Pyrrolo[2,1-c][1,4]benzodizepine - N-arylamide - Pyrrole-2-carboxylic acid or derivatives - Pyrrole-2-carboxamide - 2-heteroaryl carboxamide - Anisole - Alkyl aryl ether - N-methylpyrrole - Substituted pyrrole - Benzenoid - Heteroaromatic compound - Tertiary carboxylic acid amide - Pyrrole - Pyrrolidine - Lactam - Carboxamide group - Secondary carboxylic acid amide - Amidine - Carboxylic acid amidine - Carboxylic acid derivative - Ether - Azacycle - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Carboximidamide - Imine - Organic oxide - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Carbonyl group - Organic nitrogen compound - Organopnictogen compound - Organic oxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as pyrrolo[2,1-c][1,4]benzodiazepines. These are heterocyclic aromatic compounds containing a 1,4-benzodiazepine ring system that is fused to, and shared a nitrogen atom with a pyrrole ring.
External Descriptors
Not available