5-azanyl-1-[(4-chloranyl-2-cyano-phenyl)methyl]-1,2,3-triazole-4-carboxamide

Systemtic Name: 5-azanyl-1-[(4-chloranyl-2-cyano-phenyl)methyl]-1,2,3-triazole-4-carboxamide Openeye Name: 5-amino-1-[(4-chloro-2-cyano-phenyl)methyl]triazole-4-carboxamide CAS Name: 5-amino-1-[(4-chloro-2-cyanophenyl)methyl]-4-triazolecarboxamide IUPAC Name: 5-amino-1-[(4-chloro-2-cyanophenyl)methyl]triazole-4-carboxamide Traditional Name: 5-amino-1-(4-chloro-2-cyano-benzyl)triazole-4-carboxamide Formula: C11H9ClN6O MolecularWeight: 276.68176

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1Cl)C#N)CN2C(=C(N=N2)C(=O)N)N

Isomeric SMILES

C1=CC(=C(C=C1Cl)C#N)CN2C(=C(N=N2)C(=O)N)N

InChI

InChI=1S/C11H9ClN6O/c12-8-2-1-6(7(3-8)4-13)5-18-10(14)9(11(15)19)16-17-18/h1-3H,5,14H2,(H2,15,19)