1-(3-bromophenyl)-N-[(4-cyanophenyl)methyl]-1,2,3-triazole-4-carboxamide

Systemtic Name: 1-(3-bromophenyl)-N-[(4-cyanophenyl)methyl]-1,2,3-triazole-4-carboxamide Openeye Name: 1-(3-bromophenyl)-N-[(4-cyanophenyl)methyl]triazole-4-carboxamide CAS Name: 1-(3-bromophenyl)-N-[(4-cyanophenyl)methyl]-4-triazolecarboxamide IUPAC Name: 1-(3-bromophenyl)-N-[(4-cyanophenyl)methyl]triazole-4-carboxamide Traditional Name: 1-(3-bromophenyl)-N-(4-cyanobenzyl)triazole-4-carboxamide Formula: C17H12BrN5O MolecularWeight: 382.21408

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Br)N2C=C(N=N2)C(=O)NCC3=CC=C(C=C3)C#N

Isomeric SMILES

C1=CC(=CC(=C1)Br)N2C=C(N=N2)C(=O)NCC3=CC=C(C=C3)C#N

InChI

InChI=1S/C17H12BrN5O/c18-14-2-1-3-15(8-14)23-11-16(21-22-23)17(24)20-10-13-6-4-12(9-19)5-7-13/h1-8,11H,10H2,(H,20,24)