3-methoxy-N-[5-[2-(4-methylphenyl)-2-oxidanylidene-ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]benzamide

Systemtic Name: 3-methoxy-N-[5-[2-(4-methylphenyl)-2-oxidanylidene-ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]benzamide Openeye Name: 3-methoxy-N-[5-[2-oxo-2-(p-tolyl)ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]benzamide CAS Name: 3-methoxy-N-[5-[[2-(4-methylphenyl)-2-oxoethyl]thio]-1,3,4-thiadiazol-2-yl]benzamide IUPAC Name: 3-methoxy-N-[5-[2-(4-methylphenyl)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]benzamide Traditional Name: N-[5-[[2-keto-2-(p-tolyl)ethyl]thio]-1,3,4-thiadiazol-2-yl]-3-methoxy-benzamide Formula: C19H17N3O3S2 MolecularWeight: 399.48658

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)CSC2=NN=C(S2)NC(=O)C3=CC(=CC=C3)OC

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)CSC2=NN=C(S2)NC(=O)C3=CC(=CC=C3)OC

InChI

InChI=1S/C19H17N3O3S2/c1-12-6-8-13(9-7-12)16(23)11-26-19-22-21-18(27-19)20-17(24)14-4-3-5-15(10-14)25-2/h3-10H,11H2,1-2H3,(H,20,21,24)