(2S)-2-acetamido-N-(2-methylphenyl)-4-methylsulfonyl-butanamide

Systemtic Name: (2S)-2-acetamido-N-(2-methylphenyl)-4-methylsulfonyl-butanamide Openeye Name: (2S)-2-acetamido-4-methylsulfonyl-N-(o-tolyl)butanamide CAS Name: (2S)-2-acetamido-N-(2-methylphenyl)-4-methylsulfonylbutanamide IUPAC Name: (2S)-2-acetamido-N-(2-methylphenyl)-4-methylsulfonylbutanamide Traditional Name: (2S)-2-acetamido-4-mesyl-N-(o-tolyl)butyramide Formula: C14H20N2O4S MolecularWeight: 312.3846

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)C(CCS(=O)(=O)C)NC(=O)C

Isomeric SMILES

CC1=CC=CC=C1NC(=O)[C@H](CCS(=O)(=O)C)NC(=O)C

InChI

InChI=1S/C14H20N2O4S/c1-10-6-4-5-7-12(10)16-14(18)13(15-11(2)17)8-9-21(3,19)20/h4-7,13H,8-9H2,1-3H3,(H,15,17)(H,16,18)/t13-/m0/s1