N-(2-chloranyl-4-fluoranyl-phenyl)-4-(1H-1,2,4-triazol-5-ylsulfanylmethyl)benzamide

Systemtic Name: N-(2-chloranyl-4-fluoranyl-phenyl)-4-(1H-1,2,4-triazol-5-ylsulfanylmethyl)benzamide Openeye Name: N-(2-chloro-4-fluoro-phenyl)-4-(1H-1,2,4-triazol-5-ylsulfanylmethyl)benzamide CAS Name: N-(2-chloro-4-fluorophenyl)-4-[(1H-1,2,4-triazol-5-ylthio)methyl]benzamide IUPAC Name: N-(2-chloro-4-fluorophenyl)-4-(1H-1,2,4-triazol-5-ylsulfanylmethyl)benzamide Traditional Name: N-(2-chloro-4-fluoro-phenyl)-4-[(1H-1,2,4-triazol-5-ylthio)methyl]benzamide Formula: C16H12ClFN4OS MolecularWeight: 362.809083

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CSC2=NC=NN2)C(=O)NC3=C(C=C(C=C3)F)Cl

Isomeric SMILES

C1=CC(=CC=C1CSC2=NC=NN2)C(=O)NC3=C(C=C(C=C3)F)Cl

InChI

InChI=1S/C16H12ClFN4OS/c17-13-7-12(18)5-6-14(13)21-15(23)11-3-1-10(2-4-11)8-24-16-19-9-20-22-16/h1-7,9H,8H2,(H,21,23)(H,19,20,22)