3-[[5-[(4-phenoxyphenyl)amino]-1,3,4-thiadiazol-2-yl]sulfanyl]pentane-2,4-dione

Systemtic Name: 3-[[5-[(4-phenoxyphenyl)amino]-1,3,4-thiadiazol-2-yl]sulfanyl]pentane-2,4-dione Openeye Name: 3-[[5-(4-phenoxyanilino)-1,3,4-thiadiazol-2-yl]sulfanyl]pentane-2,4-dione CAS Name: 3-[[5-(4-phenoxyanilino)-1,3,4-thiadiazol-2-yl]thio]pentane-2,4-dione IUPAC Name: 3-[[5-(4-phenoxyanilino)-1,3,4-thiadiazol-2-yl]sulfanyl]pentane-2,4-dione Traditional Name: 3-[[5-(4-phenoxyanilino)-1,3,4-thiadiazol-2-yl]thio]pentane-2,4-dione Formula: C19H17N3O3S2 MolecularWeight: 399.48658

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(C(=O)C)SC1=NN=C(S1)NC2=CC=C(C=C2)OC3=CC=CC=C3

Isomeric SMILES

CC(=O)C(C(=O)C)SC1=NN=C(S1)NC2=CC=C(C=C2)OC3=CC=CC=C3

InChI

InChI=1S/C19H17N3O3S2/c1-12(23)17(13(2)24)26-19-22-21-18(27-19)20-14-8-10-16(11-9-14)25-15-6-4-3-5-7-15/h3-11,17H,1-2H3,(H,20,21)