(2R)-2-acetamido-N-butyl-3-(3-chloranyl-4-methyl-phenyl)sulfanyl-N-methyl-propanamide

Systemtic Name: (2R)-2-acetamido-N-butyl-3-(3-chloranyl-4-methyl-phenyl)sulfanyl-N-methyl-propanamide Openeye Name: (2R)-2-acetamido-N-butyl-3-(3-chloro-4-methyl-phenyl)sulfanyl-N-methyl-propanamide CAS Name: (2R)-2-acetamido-N-butyl-3-[(3-chloro-4-methylphenyl)thio]-N-methylpropanamide IUPAC Name: (2R)-2-acetamido-N-butyl-3-(3-chloro-4-methylphenyl)sulfanyl-N-methylpropanamide Traditional Name: (2R)-2-acetamido-N-butyl-3-[(3-chloro-4-methyl-phenyl)thio]-N-methyl-propionamide Formula: C17H25ClN2O2S MolecularWeight: 356.9106

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C)C(=O)C(CSC1=CC(=C(C=C1)C)Cl)NC(=O)C

Isomeric SMILES

CCCCN(C)C(=O)[C@H](CSC1=CC(=C(C=C1)C)Cl)NC(=O)C

InChI

InChI=1S/C17H25ClN2O2S/c1-5-6-9-20(4)17(22)16(19-13(3)21)11-23-14-8-7-12(2)15(18)10-14/h7-8,10,16H,5-6,9,11H2,1-4H3,(H,19,21)/t16-/m0/s1