N-[4-[1-(quinolin-2-ylmethyl)piperidin-4-yl]carbonylphenyl]methanesulfonamide dihydrochloride

Systemtic Name: N-[4-[1-(quinolin-2-ylmethyl)piperidin-4-yl]carbonylphenyl]methanesulfonamide dihydrochloride Openeye Name: N-[4-[1-(2-quinolylmethyl)piperidine-4-carbonyl]phenyl]methanesulfonamide dihydrochloride CAS Name: N-[4-[oxo-[1-(2-quinolinylmethyl)-4-piperidinyl]methyl]phenyl]methanesulfonamide dihydrochloride IUPAC Name: N-[4-[1-(quinolin-2-ylmethyl)piperidine-4-carbonyl]phenyl]methanesulfonamide dihydrochloride Traditional Name: N-[4-[1-(2-quinolylmethyl)isonipecotoyl]phenyl]methanesulfonamide dihydrochloride Formula: C23H27Cl2N3O3S MolecularWeight: 496.44978

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NC1=CC=C(C=C1)C(=O)C2CCN(CC2)CC3=NC4=CC=CC=C4C=C3.Cl.Cl

Isomeric SMILES

CS(=O)(=O)NC1=CC=C(C=C1)C(=O)C2CCN(CC2)CC3=NC4=CC=CC=C4C=C3.Cl.Cl

InChI

InChI=1S/C23H25N3O3S.2ClH/c1-30(28,29)25-20-9-7-18(8-10-20)23(27)19-12-14-26(15-13-19)16-21-11-6-17-4-2-3-5-22(17)24-21;;/h2-11,19,25H,12-16H2,1H3;2*1H