(2R)-2-acetamido-3-(3-chloranyl-4-methyl-phenyl)sulfanyl-N-[(4-methylphenyl)methyl]propanamide

Systemtic Name: (2R)-2-acetamido-3-(3-chloranyl-4-methyl-phenyl)sulfanyl-N-[(4-methylphenyl)methyl]propanamide Openeye Name: (2R)-2-acetamido-3-(3-chloro-4-methyl-phenyl)sulfanyl-N-(p-tolylmethyl)propanamide CAS Name: (2R)-2-acetamido-3-[(3-chloro-4-methylphenyl)thio]-N-[(4-methylphenyl)methyl]propanamide IUPAC Name: (2R)-2-acetamido-3-(3-chloro-4-methylphenyl)sulfanyl-N-[(4-methylphenyl)methyl]propanamide Traditional Name: (2R)-2-acetamido-3-[(3-chloro-4-methyl-phenyl)thio]-N-(4-methylbenzyl)propionamide Formula: C20H23ClN2O2S MolecularWeight: 390.92682

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC(=O)C(CSC2=CC(=C(C=C2)C)Cl)NC(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)CNC(=O)[C@H](CSC2=CC(=C(C=C2)C)Cl)NC(=O)C

InChI

InChI=1S/C20H23ClN2O2S/c1-13-4-7-16(8-5-13)11-22-20(25)19(23-15(3)24)12-26-17-9-6-14(2)18(21)10-17/h4-10,19H,11-12H2,1-3H3,(H,22,25)(H,23,24)/t19-/m0/s1