4-tert-butyl-N-[3-[2-(4-methylphenyl)sulfanylpropanoylamino]phenyl]benzamide

Systemtic Name: 4-tert-butyl-N-[3-[2-(4-methylphenyl)sulfanylpropanoylamino]phenyl]benzamide Openeye Name: 4-tert-butyl-N-[3-[2-(p-tolylsulfanyl)propanoylamino]phenyl]benzamide CAS Name: 4-tert-butyl-N-[3-[[2-[(4-methylphenyl)thio]-1-oxopropyl]amino]phenyl]benzamide IUPAC Name: 4-tert-butyl-N-[3-[2-(4-methylphenyl)sulfanylpropanoylamino]phenyl]benzamide Traditional Name: 4-tert-butyl-N-[3-[2-(p-tolylthio)propanoylamino]phenyl]benzamide Formula: C27H30N2O2S MolecularWeight: 446.6043

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC(C)C(=O)NC2=CC=CC(=C2)NC(=O)C3=CC=C(C=C3)C(C)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)SC(C)C(=O)NC2=CC=CC(=C2)NC(=O)C3=CC=C(C=C3)C(C)(C)C

InChI

InChI=1S/C27H30N2O2S/c1-18-9-15-24(16-10-18)32-19(2)25(30)28-22-7-6-8-23(17-22)29-26(31)20-11-13-21(14-12-20)27(3,4)5/h6-17,19H,1-5H3,(H,28,30)(H,29,31)