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

Systemtic Name: 5-azanyl-1-[(4-bromophenyl)methyl]-N-(4-fluoranyl-2-methyl-phenyl)-1,2,3-triazole-4-carboxamide Openeye Name: 5-amino-1-[(4-bromophenyl)methyl]-N-(4-fluoro-2-methyl-phenyl)triazole-4-carboxamide CAS Name: 5-amino-1-[(4-bromophenyl)methyl]-N-(4-fluoro-2-methylphenyl)-4-triazolecarboxamide IUPAC Name: 5-amino-1-[(4-bromophenyl)methyl]-N-(4-fluoro-2-methylphenyl)triazole-4-carboxamide Traditional Name: 5-amino-1-(4-bromobenzyl)-N-(4-fluoro-2-methyl-phenyl)triazole-4-carboxamide Formula: C17H15BrFN5O MolecularWeight: 404.236303

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)F)NC(=O)C2=C(N(N=N2)CC3=CC=C(C=C3)Br)N

Isomeric SMILES

CC1=C(C=CC(=C1)F)NC(=O)C2=C(N(N=N2)CC3=CC=C(C=C3)Br)N

InChI

InChI=1S/C17H15BrFN5O/c1-10-8-13(19)6-7-14(10)21-17(25)15-16(20)24(23-22-15)9-11-2-4-12(18)5-3-11/h2-8H,9,20H2,1H3,(H,21,25)