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

Systemtic Name: 5-azanyl-1-[(3-bromophenyl)methyl]-N-phenyl-1,2,3-triazole-4-carboxamide Openeye Name: 5-amino-1-[(3-bromophenyl)methyl]-N-phenyl-triazole-4-carboxamide CAS Name: 5-amino-1-[(3-bromophenyl)methyl]-N-phenyl-4-triazolecarboxamide IUPAC Name: 5-amino-1-[(3-bromophenyl)methyl]-N-phenyltriazole-4-carboxamide Traditional Name: 5-amino-1-(3-bromobenzyl)-N-phenyl-triazole-4-carboxamide Formula: C16H14BrN5O MolecularWeight: 372.21926

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=O)C2=C(N(N=N2)CC3=CC(=CC=C3)Br)N

Isomeric SMILES

C1=CC=C(C=C1)NC(=O)C2=C(N(N=N2)CC3=CC(=CC=C3)Br)N

InChI

InChI=1S/C16H14BrN5O/c17-12-6-4-5-11(9-12)10-22-15(18)14(20-21-22)16(23)19-13-7-2-1-3-8-13/h1-9H,10,18H2,(H,19,23)