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

Systemtic Name: (2S)-2-acetamido-N-(4-butylphenyl)-4-methylsulfonyl-butanamide Openeye Name: (2S)-2-acetamido-N-(4-butylphenyl)-4-methylsulfonyl-butanamide CAS Name: (2S)-2-acetamido-N-(4-butylphenyl)-4-methylsulfonylbutanamide IUPAC Name: (2S)-2-acetamido-N-(4-butylphenyl)-4-methylsulfonylbutanamide Traditional Name: (2S)-2-acetamido-N-(4-butylphenyl)-4-mesyl-butyramide Formula: C17H26N2O4S MolecularWeight: 354.46434

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=O)C(CCS(=O)(=O)C)NC(=O)C

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=O)[C@H](CCS(=O)(=O)C)NC(=O)C

InChI

InChI=1S/C17H26N2O4S/c1-4-5-6-14-7-9-15(10-8-14)19-17(21)16(18-13(2)20)11-12-24(3,22)23/h7-10,16H,4-6,11-12H2,1-3H3,(H,18,20)(H,19,21)/t16-/m0/s1