N-[5-(4-methoxyphenyl)-1,3,4-thiadiazol-2-yl]-2-(4-methylphenyl)sulfanyl-butanamide

Systemtic Name: N-[5-(4-methoxyphenyl)-1,3,4-thiadiazol-2-yl]-2-(4-methylphenyl)sulfanyl-butanamide Openeye Name: N-[5-(4-methoxyphenyl)-1,3,4-thiadiazol-2-yl]-2-(p-tolylsulfanyl)butanamide CAS Name: N-[5-(4-methoxyphenyl)-1,3,4-thiadiazol-2-yl]-2-[(4-methylphenyl)thio]butanamide IUPAC Name: N-[5-(4-methoxyphenyl)-1,3,4-thiadiazol-2-yl]-2-(4-methylphenyl)sulfanylbutanamide Traditional Name: N-[5-(4-methoxyphenyl)-1,3,4-thiadiazol-2-yl]-2-(p-tolylthio)butyramide Formula: C20H21N3O2S2 MolecularWeight: 399.52964

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=NN=C(S1)C2=CC=C(C=C2)OC)SC3=CC=C(C=C3)C

Isomeric SMILES

CCC(C(=O)NC1=NN=C(S1)C2=CC=C(C=C2)OC)SC3=CC=C(C=C3)C

InChI

InChI=1S/C20H21N3O2S2/c1-4-17(26-16-11-5-13(2)6-12-16)18(24)21-20-23-22-19(27-20)14-7-9-15(25-3)10-8-14/h5-12,17H,4H2,1-3H3,(H,21,23,24)