N-[3-[[3-(4-chlorophenyl)sulfanylpropanoylamino]methyl]phenyl]-2-methyl-propanamide

Systemtic Name: N-[3-[[3-(4-chlorophenyl)sulfanylpropanoylamino]methyl]phenyl]-2-methyl-propanamide Openeye Name: N-[3-[[3-(4-chlorophenyl)sulfanylpropanoylamino]methyl]phenyl]-2-methyl-propanamide CAS Name: N-[3-[[[3-[(4-chlorophenyl)thio]-1-oxopropyl]amino]methyl]phenyl]-2-methylpropanamide IUPAC Name: N-[3-[[3-(4-chlorophenyl)sulfanylpropanoylamino]methyl]phenyl]-2-methylpropanamide Traditional Name: N-[3-[[3-[(4-chlorophenyl)thio]propanoylamino]methyl]phenyl]-2-methyl-propionamide Formula: C20H23ClN2O2S MolecularWeight: 390.92682

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NC1=CC=CC(=C1)CNC(=O)CCSC2=CC=C(C=C2)Cl

Isomeric SMILES

CC(C)C(=O)NC1=CC=CC(=C1)CNC(=O)CCSC2=CC=C(C=C2)Cl

InChI

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