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

Systemtic Name: 5-azanyl-1-[(4-bromophenyl)methyl]-N-(3-fluorophenyl)-1,2,3-triazole-4-carboxamide Openeye Name: 5-amino-1-[(4-bromophenyl)methyl]-N-(3-fluorophenyl)triazole-4-carboxamide CAS Name: 5-amino-1-[(4-bromophenyl)methyl]-N-(3-fluorophenyl)-4-triazolecarboxamide IUPAC Name: 5-amino-1-[(4-bromophenyl)methyl]-N-(3-fluorophenyl)triazole-4-carboxamide Traditional Name: 5-amino-1-(4-bromobenzyl)-N-(3-fluorophenyl)triazole-4-carboxamide Formula: C16H13BrFN5O MolecularWeight: 390.209723

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H13BrFN5O/c17-11-6-4-10(5-7-11)9-23-15(19)14(21-22-23)16(24)20-13-3-1-2-12(18)8-13/h1-8H,9,19H2,(H,20,24)