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

Systemtic Name: N-[4-[1-(pyridin-4-ylmethyl)piperidin-4-yl]carbonylphenyl]methanesulfonamide dihydrochloride Openeye Name: N-[4-[1-(4-pyridylmethyl)piperidine-4-carbonyl]phenyl]methanesulfonamide dihydrochloride CAS Name: N-[4-[oxo-[1-(pyridin-4-ylmethyl)-4-piperidinyl]methyl]phenyl]methanesulfonamide dihydrochloride IUPAC Name: N-[4-[1-(pyridin-4-ylmethyl)piperidine-4-carbonyl]phenyl]methanesulfonamide dihydrochloride Traditional Name: N-[4-[1-(4-pyridylmethyl)isonipecotoyl]phenyl]methanesulfonamide dihydrochloride Formula: C19H25Cl2N3O3S MolecularWeight: 446.3911

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H23N3O3S.2ClH/c1-26(24,25)21-18-4-2-16(3-5-18)19(23)17-8-12-22(13-9-17)14-15-6-10-20-11-7-15;;/h2-7,10-11,17,21H,8-9,12-14H2,1H3;2*1H