N-[[1-(4-propan-2-ylsulfanylphenyl)carbonylpiperidin-3-yl]methyl]methanesulfonamide

Systemtic Name: N-[[1-(4-propan-2-ylsulfanylphenyl)carbonylpiperidin-3-yl]methyl]methanesulfonamide Openeye Name: N-[[1-(4-isopropylsulfanylbenzoyl)-3-piperidyl]methyl]methanesulfonamide CAS Name: N-[[1-[oxo-[4-(propan-2-ylthio)phenyl]methyl]-3-piperidinyl]methyl]methanesulfonamide IUPAC Name: N-[[1-(4-propan-2-ylsulfanylbenzoyl)piperidin-3-yl]methyl]methanesulfonamide Traditional Name: N-[[1-[4-(isopropylthio)benzoyl]-3-piperidyl]methyl]methanesulfonamide Formula: C17H26N2O3S2 MolecularWeight: 370.52994

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)SC1=CC=C(C=C1)C(=O)N2CCCC(C2)CNS(=O)(=O)C

Isomeric SMILES

CC(C)SC1=CC=C(C=C1)C(=O)N2CCCC(C2)CNS(=O)(=O)C

InChI

InChI=1S/C17H26N2O3S2/c1-13(2)23-16-8-6-15(7-9-16)17(20)19-10-4-5-14(12-19)11-18-24(3,21)22/h6-9,13-14,18H,4-5,10-12H2,1-3H3