1,2-diphenyl-2-(1H-1,2,4-triazol-5-ylsulfanyl)ethanone

Systemtic Name: 1,2-diphenyl-2-(1H-1,2,4-triazol-5-ylsulfanyl)ethanone Openeye Name: 1,2-diphenyl-2-(1H-1,2,4-triazol-5-ylsulfanyl)ethanone CAS Name: 1,2-diphenyl-2-(1H-1,2,4-triazol-5-ylthio)ethanone IUPAC Name: 1,2-diphenyl-2-(1H-1,2,4-triazol-5-ylsulfanyl)ethanone Traditional Name: 1,2-diphenyl-2-(1H-1,2,4-triazol-5-ylthio)ethanone Formula: C16H13N3OS MolecularWeight: 295.35892

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C(=O)C2=CC=CC=C2)SC3=NC=NN3

Isomeric SMILES

C1=CC=C(C=C1)C(C(=O)C2=CC=CC=C2)SC3=NC=NN3

InChI

InChI=1S/C16H13N3OS/c20-14(12-7-3-1-4-8-12)15(13-9-5-2-6-10-13)21-16-17-11-18-19-16/h1-11,15H,(H,17,18,19)