4-[(4-chlorophenyl)sulfanylmethyl]-N-[2-(2-methylpropanoylamino)ethyl]benzamide

Systemtic Name: 4-[(4-chlorophenyl)sulfanylmethyl]-N-[2-(2-methylpropanoylamino)ethyl]benzamide Openeye Name: 4-[(4-chlorophenyl)sulfanylmethyl]-N-[2-(2-methylpropanoylamino)ethyl]benzamide CAS Name: 4-[[(4-chlorophenyl)thio]methyl]-N-[2-[(2-methyl-1-oxopropyl)amino]ethyl]benzamide IUPAC Name: 4-[(4-chlorophenyl)sulfanylmethyl]-N-[2-(2-methylpropanoylamino)ethyl]benzamide Traditional Name: 4-[[(4-chlorophenyl)thio]methyl]-N-[2-(isobutyrylamino)ethyl]benzamide Formula: C20H23ClN2O2S MolecularWeight: 390.92682

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NCCNC(=O)C1=CC=C(C=C1)CSC2=CC=C(C=C2)Cl

Isomeric SMILES

CC(C)C(=O)NCCNC(=O)C1=CC=C(C=C1)CSC2=CC=C(C=C2)Cl

InChI

InChI=1S/C20H23ClN2O2S/c1-14(2)19(24)22-11-12-23-20(25)16-5-3-15(4-6-16)13-26-18-9-7-17(21)8-10-18/h3-10,14H,11-13H2,1-2H3,(H,22,24)(H,23,25)