1-(3,4-diphenyl-5-sulfanylidene-1,2,4-triazol-1-yl)ethanone

Systemtic Name: 1-(3,4-diphenyl-5-sulfanylidene-1,2,4-triazol-1-yl)ethanone Openeye Name: 1-(3,4-diphenyl-5-thioxo-1,2,4-triazol-1-yl)ethanone CAS Name: 1-(3,4-diphenyl-5-sulfanylidene-1,2,4-triazol-1-yl)ethanone IUPAC Name: 1-(3,4-diphenyl-5-sulfanylidene-1,2,4-triazol-1-yl)ethanone Traditional Name: 1-(3,4-diphenyl-5-thioxo-1,2,4-triazol-1-yl)ethanone Formula: C16H13N3OS MolecularWeight: 295.35892

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1C(=S)N(C(=N1)C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CC(=O)N1C(=S)N(C(=N1)C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C16H13N3OS/c1-12(20)19-16(21)18(14-10-6-3-7-11-14)15(17-19)13-8-4-2-5-9-13/h2-11H,1H3