N-(3,4-dimethoxyphenyl)-N-[1-(pyridin-4-ylmethyl)piperidin-4-yl]benzenesulfonamide

Systemtic Name: N-(3,4-dimethoxyphenyl)-N-[1-(pyridin-4-ylmethyl)piperidin-4-yl]benzenesulfonamide Openeye Name: N-(3,4-dimethoxyphenyl)-N-[1-(4-pyridylmethyl)-4-piperidyl]benzenesulfonamide CAS Name: N-(3,4-dimethoxyphenyl)-N-[1-(pyridin-4-ylmethyl)-4-piperidinyl]benzenesulfonamide IUPAC Name: N-(3,4-dimethoxyphenyl)-N-[1-(pyridin-4-ylmethyl)piperidin-4-yl]benzenesulfonamide Traditional Name: N-(3,4-dimethoxyphenyl)-N-[1-(4-pyridylmethyl)-4-piperidyl]benzenesulfonamide Formula: C25H29N3O4S MolecularWeight: 467.58046

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)N(C2CCN(CC2)CC3=CC=NC=C3)S(=O)(=O)C4=CC=CC=C4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)N(C2CCN(CC2)CC3=CC=NC=C3)S(=O)(=O)C4=CC=CC=C4)OC

InChI

InChI=1S/C25H29N3O4S/c1-31-24-9-8-22(18-25(24)32-2)28(33(29,30)23-6-4-3-5-7-23)21-12-16-27(17-13-21)19-20-10-14-26-15-11-20/h3-11,14-15,18,21H,12-13,16-17,19H2,1-2H3