3-[(4,5-diphenyl-1,2,4-triazol-3-yl)sulfanyl]pentane-2,4-dione

Systemtic Name: 3-[(4,5-diphenyl-1,2,4-triazol-3-yl)sulfanyl]pentane-2,4-dione Openeye Name: 3-[(4,5-diphenyl-1,2,4-triazol-3-yl)sulfanyl]pentane-2,4-dione CAS Name: 3-[(4,5-diphenyl-1,2,4-triazol-3-yl)thio]pentane-2,4-dione IUPAC Name: 3-[(4,5-diphenyl-1,2,4-triazol-3-yl)sulfanyl]pentane-2,4-dione Traditional Name: 3-[(4,5-diphenyl-1,2,4-triazol-3-yl)thio]pentane-2,4-dione Formula: C19H17N3O2S MolecularWeight: 351.42218

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(C(=O)C)SC1=NN=C(N1C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CC(=O)C(C(=O)C)SC1=NN=C(N1C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C19H17N3O2S/c1-13(23)17(14(2)24)25-19-21-20-18(15-9-5-3-6-10-15)22(19)16-11-7-4-8-12-16/h3-12,17H,1-2H3