N-[4-[1-(2-pyridin-3-ylethyl)piperidin-4-yl]carbonylphenyl]methanesulfonamide dihydrochloride

Systemtic Name: N-[4-[1-(2-pyridin-3-ylethyl)piperidin-4-yl]carbonylphenyl]methanesulfonamide dihydrochloride Openeye Name: N-[4-[1-[2-(3-pyridyl)ethyl]piperidine-4-carbonyl]phenyl]methanesulfonamide dihydrochloride CAS Name: N-[4-[oxo-[1-[2-(3-pyridinyl)ethyl]-4-piperidinyl]methyl]phenyl]methanesulfonamide dihydrochloride IUPAC Name: N-[4-[1-(2-pyridin-3-ylethyl)piperidine-4-carbonyl]phenyl]methanesulfonamide dihydrochloride Traditional Name: N-[4-[1-[2-(3-pyridyl)ethyl]isonipecotoyl]phenyl]methanesulfonamide dihydrochloride Formula: C20H27Cl2N3O3S MolecularWeight: 460.41768

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NC1=CC=C(C=C1)C(=O)C2CCN(CC2)CCC3=CN=CC=C3.Cl.Cl

Isomeric SMILES

CS(=O)(=O)NC1=CC=C(C=C1)C(=O)C2CCN(CC2)CCC3=CN=CC=C3.Cl.Cl

InChI

InChI=1S/C20H25N3O3S.2ClH/c1-27(25,26)22-19-6-4-17(5-7-19)20(24)18-9-13-23(14-10-18)12-8-16-3-2-11-21-15-16;;/h2-7,11,15,18,22H,8-10,12-14H2,1H3;2*1H