(2S)-3-methyl-2-[(4-methylphenyl)sulfonylamino]-N-[3-(2-oxidanylideneazepan-1-yl)propyl]butanamide

Systemtic Name: (2S)-3-methyl-2-[(4-methylphenyl)sulfonylamino]-N-[3-(2-oxidanylideneazepan-1-yl)propyl]butanamide Openeye Name: (2S)-3-methyl-N-[3-(2-oxoazepan-1-yl)propyl]-2-(p-tolylsulfonylamino)butanamide CAS Name: (2S)-3-methyl-2-[(4-methylphenyl)sulfonylamino]-N-[3-(2-oxo-1-azepanyl)propyl]butanamide IUPAC Name: (2S)-3-methyl-2-[(4-methylphenyl)sulfonylamino]-N-[3-(2-oxoazepan-1-yl)propyl]butanamide Traditional Name: (2S)-N-[3-(2-ketoazepan-1-yl)propyl]-3-methyl-2-(tosylamino)butyramide Formula: C21H33N3O4S MolecularWeight: 423.56942

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(C(C)C)C(=O)NCCCN2CCCCCC2=O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N[C@@H](C(C)C)C(=O)NCCCN2CCCCCC2=O

InChI

InChI=1S/C21H33N3O4S/c1-16(2)20(23-29(27,28)18-11-9-17(3)10-12-18)21(26)22-13-7-15-24-14-6-4-5-8-19(24)25/h9-12,16,20,23H,4-8,13-15H2,1-3H3,(H,22,26)/t20-/m0/s1