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

Systemtic Name: 5-azanyl-1-[(4-bromanyl-2-fluoranyl-phenyl)methyl]-N-(4-chlorophenyl)-1,2,3-triazole-4-carboxamide Openeye Name: 5-amino-1-[(4-bromo-2-fluoro-phenyl)methyl]-N-(4-chlorophenyl)triazole-4-carboxamide CAS Name: 5-amino-1-[(4-bromo-2-fluorophenyl)methyl]-N-(4-chlorophenyl)-4-triazolecarboxamide IUPAC Name: 5-amino-1-[(4-bromo-2-fluorophenyl)methyl]-N-(4-chlorophenyl)triazole-4-carboxamide Traditional Name: 5-amino-1-(4-bromo-2-fluoro-benzyl)-N-(4-chlorophenyl)triazole-4-carboxamide Formula: C16H12BrClFN5O MolecularWeight: 424.654783

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC(=O)C2=C(N(N=N2)CC3=C(C=C(C=C3)Br)F)N)Cl

Isomeric SMILES

C1=CC(=CC=C1NC(=O)C2=C(N(N=N2)CC3=C(C=C(C=C3)Br)F)N)Cl

InChI

InChI=1S/C16H12BrClFN5O/c17-10-2-1-9(13(19)7-10)8-24-15(20)14(22-23-24)16(25)21-12-5-3-11(18)4-6-12/h1-7H,8,20H2,(H,21,25)