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

Systemtic Name: 4-tert-butyl-N-[3-[3-(4-chlorophenyl)sulfanylpropanoylamino]phenyl]benzamide Openeye Name: 4-tert-butyl-N-[3-[3-(4-chlorophenyl)sulfanylpropanoylamino]phenyl]benzamide CAS Name: 4-tert-butyl-N-[3-[[3-[(4-chlorophenyl)thio]-1-oxopropyl]amino]phenyl]benzamide IUPAC Name: 4-tert-butyl-N-[3-[3-(4-chlorophenyl)sulfanylpropanoylamino]phenyl]benzamide Traditional Name: 4-tert-butyl-N-[3-[3-[(4-chlorophenyl)thio]propanoylamino]phenyl]benzamide Formula: C26H27ClN2O2S MolecularWeight: 467.02278

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)NC2=CC(=CC=C2)NC(=O)CCSC3=CC=C(C=C3)Cl

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)NC2=CC(=CC=C2)NC(=O)CCSC3=CC=C(C=C3)Cl

InChI

InChI=1S/C26H27ClN2O2S/c1-26(2,3)19-9-7-18(8-10-19)25(31)29-22-6-4-5-21(17-22)28-24(30)15-16-32-23-13-11-20(27)12-14-23/h4-14,17H,15-16H2,1-3H3,(H,28,30)(H,29,31)