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

Systemtic Name: (2S)-2-acetamido-N-tert-butyl-3-(3-chloranyl-4-methyl-phenyl)sulfanyl-propanamide Openeye Name: (2S)-2-acetamido-N-tert-butyl-3-(3-chloro-4-methyl-phenyl)sulfanyl-propanamide CAS Name: (2S)-2-acetamido-N-tert-butyl-3-[(3-chloro-4-methylphenyl)thio]propanamide IUPAC Name: (2S)-2-acetamido-N-tert-butyl-3-(3-chloro-4-methylphenyl)sulfanylpropanamide Traditional Name: (2S)-2-acetamido-N-tert-butyl-3-[(3-chloro-4-methyl-phenyl)thio]propionamide Formula: C16H23ClN2O2S MolecularWeight: 342.88402

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)SCC(C(=O)NC(C)(C)C)NC(=O)C)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)SC[C@H](C(=O)NC(C)(C)C)NC(=O)C)Cl

InChI

InChI=1S/C16H23ClN2O2S/c1-10-6-7-12(8-13(10)17)22-9-14(18-11(2)20)15(21)19-16(3,4)5/h6-8,14H,9H2,1-5H3,(H,18,20)(H,19,21)/t14-/m1/s1