(2S)-2-[(2-fluorophenyl)sulfonylamino]-4-methylsulfanyl-N-(4-piperidin-1-ylphenyl)butanamide

Systemtic Name: (2S)-2-[(2-fluorophenyl)sulfonylamino]-4-methylsulfanyl-N-(4-piperidin-1-ylphenyl)butanamide Openeye Name: (2S)-2-[(2-fluorophenyl)sulfonylamino]-4-methylsulfanyl-N-[4-(1-piperidyl)phenyl]butanamide CAS Name: (2S)-2-[(2-fluorophenyl)sulfonylamino]-4-(methylthio)-N-[4-(1-piperidinyl)phenyl]butanamide IUPAC Name: (2S)-2-[(2-fluorophenyl)sulfonylamino]-4-methylsulfanyl-N-(4-piperidin-1-ylphenyl)butanamide Traditional Name: (2S)-2-[(2-fluorophenyl)sulfonylamino]-4-(methylthio)-N-(4-piperidinophenyl)butyramide Formula: C22H28FN3O3S2 MolecularWeight: 465.604423

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)NC1=CC=C(C=C1)N2CCCCC2)NS(=O)(=O)C3=CC=CC=C3F

Isomeric SMILES

CSCC[C@@H](C(=O)NC1=CC=C(C=C1)N2CCCCC2)NS(=O)(=O)C3=CC=CC=C3F

InChI

InChI=1S/C22H28FN3O3S2/c1-30-16-13-20(25-31(28,29)21-8-4-3-7-19(21)23)22(27)24-17-9-11-18(12-10-17)26-14-5-2-6-15-26/h3-4,7-12,20,25H,2,5-6,13-16H2,1H3,(H,24,27)/t20-/m0/s1