N-[4-[1-(3-pyridin-4-ylpropyl)piperidin-4-yl]carbonylphenyl]methanesulfonamide dihydrochloride

Systemtic Name: N-[4-[1-(3-pyridin-4-ylpropyl)piperidin-4-yl]carbonylphenyl]methanesulfonamide dihydrochloride Openeye Name: N-[4-[1-[3-(4-pyridyl)propyl]piperidine-4-carbonyl]phenyl]methanesulfonamide dihydrochloride CAS Name: N-[4-[oxo-[1-(3-pyridin-4-ylpropyl)-4-piperidinyl]methyl]phenyl]methanesulfonamide dihydrochloride IUPAC Name: N-[4-[1-(3-pyridin-4-ylpropyl)piperidine-4-carbonyl]phenyl]methanesulfonamide dihydrochloride Traditional Name: N-[4-[1-[3-(4-pyridyl)propyl]isonipecotoyl]phenyl]methanesulfonamide dihydrochloride Formula: C21H29Cl2N3O3S MolecularWeight: 474.44426

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NC1=CC=C(C=C1)C(=O)C2CCN(CC2)CCCC3=CC=NC=C3.Cl.Cl

Isomeric SMILES

CS(=O)(=O)NC1=CC=C(C=C1)C(=O)C2CCN(CC2)CCCC3=CC=NC=C3.Cl.Cl

InChI

InChI=1S/C21H27N3O3S.2ClH/c1-28(26,27)23-20-6-4-18(5-7-20)21(25)19-10-15-24(16-11-19)14-2-3-17-8-12-22-13-9-17;;/h4-9,12-13,19,23H,2-3,10-11,14-16H2,1H3;2*1H