5-azanyl-1-(3-bromophenyl)-N-[(2-chlorophenyl)methyl]-1,2,3-triazole-4-carboxamide

Systemtic Name: 5-azanyl-1-(3-bromophenyl)-N-[(2-chlorophenyl)methyl]-1,2,3-triazole-4-carboxamide Openeye Name: 5-amino-1-(3-bromophenyl)-N-[(2-chlorophenyl)methyl]triazole-4-carboxamide CAS Name: 5-amino-1-(3-bromophenyl)-N-[(2-chlorophenyl)methyl]-4-triazolecarboxamide IUPAC Name: 5-amino-1-(3-bromophenyl)-N-[(2-chlorophenyl)methyl]triazole-4-carboxamide Traditional Name: 5-amino-1-(3-bromophenyl)-N-(2-chlorobenzyl)triazole-4-carboxamide Formula: C16H13BrClN5O MolecularWeight: 406.66432

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CNC(=O)C2=C(N(N=N2)C3=CC(=CC=C3)Br)N)Cl

Isomeric SMILES

C1=CC=C(C(=C1)CNC(=O)C2=C(N(N=N2)C3=CC(=CC=C3)Br)N)Cl

InChI

InChI=1S/C16H13BrClN5O/c17-11-5-3-6-12(8-11)23-15(19)14(21-22-23)16(24)20-9-10-4-1-2-7-13(10)18/h1-8H,9,19H2,(H,20,24)