3,4-dimethoxy-N-[5-[2-(4-methylphenyl)sulfanylethyl]-1,3,4-thiadiazol-2-yl]benzamide

Systemtic Name: 3,4-dimethoxy-N-[5-[2-(4-methylphenyl)sulfanylethyl]-1,3,4-thiadiazol-2-yl]benzamide Openeye Name: 3,4-dimethoxy-N-[5-[2-(p-tolylsulfanyl)ethyl]-1,3,4-thiadiazol-2-yl]benzamide CAS Name: 3,4-dimethoxy-N-[5-[2-[(4-methylphenyl)thio]ethyl]-1,3,4-thiadiazol-2-yl]benzamide IUPAC Name: 3,4-dimethoxy-N-[5-[2-(4-methylphenyl)sulfanylethyl]-1,3,4-thiadiazol-2-yl]benzamide Traditional Name: 3,4-dimethoxy-N-[5-[2-(p-tolylthio)ethyl]-1,3,4-thiadiazol-2-yl]benzamide Formula: C20H21N3O3S2 MolecularWeight: 415.52904

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCCC2=NN=C(S2)NC(=O)C3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CC1=CC=C(C=C1)SCCC2=NN=C(S2)NC(=O)C3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C20H21N3O3S2/c1-13-4-7-15(8-5-13)27-11-10-18-22-23-20(28-18)21-19(24)14-6-9-16(25-2)17(12-14)26-3/h4-9,12H,10-11H2,1-3H3,(H,21,23,24)