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

Systemtic Name: 3,5-ditert-butyl-N-[5-[2-(4-methylphenyl)sulfanylethyl]-1,3,4-thiadiazol-2-yl]benzamide Openeye Name: 3,5-ditert-butyl-N-[5-[2-(p-tolylsulfanyl)ethyl]-1,3,4-thiadiazol-2-yl]benzamide CAS Name: 3,5-ditert-butyl-N-[5-[2-[(4-methylphenyl)thio]ethyl]-1,3,4-thiadiazol-2-yl]benzamide IUPAC Name: 3,5-ditert-butyl-N-[5-[2-(4-methylphenyl)sulfanylethyl]-1,3,4-thiadiazol-2-yl]benzamide Traditional Name: 3,5-ditert-butyl-N-[5-[2-(p-tolylthio)ethyl]-1,3,4-thiadiazol-2-yl]benzamide Formula: C26H33N3OS2 MolecularWeight: 467.68972

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H33N3OS2/c1-17-8-10-21(11-9-17)31-13-12-22-28-29-24(32-22)27-23(30)18-14-19(25(2,3)4)16-20(15-18)26(5,6)7/h8-11,14-16H,12-13H2,1-7H3,(H,27,29,30)