N-[3-[[2-[(3-chlorophenyl)methylsulfanyl]ethanoylamino]methyl]phenyl]-2-methyl-propanamide

Systemtic Name: N-[3-[[2-[(3-chlorophenyl)methylsulfanyl]ethanoylamino]methyl]phenyl]-2-methyl-propanamide Openeye Name: N-[3-[[[2-[(3-chlorophenyl)methylsulfanyl]acetyl]amino]methyl]phenyl]-2-methyl-propanamide CAS Name: N-[3-[[[2-[(3-chlorophenyl)methylthio]-1-oxoethyl]amino]methyl]phenyl]-2-methylpropanamide IUPAC Name: N-[3-[[[2-[(3-chlorophenyl)methylsulfanyl]acetyl]amino]methyl]phenyl]-2-methylpropanamide Traditional Name: N-[3-[[[2-[(3-chlorobenzyl)thio]acetyl]amino]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)CSCC2=CC(=CC=C2)Cl

Isomeric SMILES

CC(C)C(=O)NC1=CC=CC(=C1)CNC(=O)CSCC2=CC(=CC=C2)Cl

InChI

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