Compound Identification
SMILES
O=C(CNC(=O)NC1=NNC(=S)S1)NNC=C1C=CC=CC1=O
InChIKey
InChIKey=OCKSOUKXCQQJIH-UHFFFAOYSA-N
Formula
C12H12N6O3S2
Mass
352.39
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- 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 - Alpha amino acids and derivatives
Direct Parent
N-carbamoyl-alpha amino acids and derivatives
Alternative Parents
1,3,4-thiadiazol-2-ylureas O-quinomethanes Vinylogous amides Heteroaromatic compounds Ureas Carboxylic acid hydrazides Azacyclic compounds Organosulfur compounds Organopnictogen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
N-carbamoyl-alpha-amino acid or derivatives - 1,3,4-thiadiazol-2-ylurea - O-quinomethane - Quinomethane - Azole - Thiadiazole - Vinylogous amide - Heteroaromatic compound - Carboxylic acid hydrazide - Cyclic ketone - Urea - Ketone - Carbonic acid derivative - Organoheterocyclic compound - Azacycle - Organic oxide - Organooxygen compound - Organonitrogen compound - Organosulfur compound - Organic oxygen compound - Organic nitrogen compound - Organopnictogen compound - Carbonyl group - Hydrocarbon derivative - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as n-carbamoyl-alpha amino acids and derivatives. These are compounds containing an alpha amino acid (or a derivative thereof) which bears an carbamoyl group at its terminal nitrogen atom.
External Descriptors
Not available