N-(5-chloranyl-2-fluoranyl-phenyl)-1-(phenylmethyl)-1,2,3-triazole-4-carboxamide

Systemtic Name: N-(5-chloranyl-2-fluoranyl-phenyl)-1-(phenylmethyl)-1,2,3-triazole-4-carboxamide Openeye Name: 1-benzyl-N-(5-chloro-2-fluoro-phenyl)triazole-4-carboxamide CAS Name: N-(5-chloro-2-fluorophenyl)-1-(phenylmethyl)-4-triazolecarboxamide IUPAC Name: 1-benzyl-N-(5-chloro-2-fluorophenyl)triazole-4-carboxamide Traditional Name: 1-benzyl-N-(5-chloro-2-fluoro-phenyl)triazole-4-carboxamide Formula: C16H12ClFN4O MolecularWeight: 330.744083

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C=C(N=N2)C(=O)NC3=C(C=CC(=C3)Cl)F

Isomeric SMILES

C1=CC=C(C=C1)CN2C=C(N=N2)C(=O)NC3=C(C=CC(=C3)Cl)F

InChI

InChI=1S/C16H12ClFN4O/c17-12-6-7-13(18)14(8-12)19-16(23)15-10-22(21-20-15)9-11-4-2-1-3-5-11/h1-8,10H,9H2,(H,19,23)