N-[1-(4-methoxypyrimidin-2-yl)piperidin-4-yl]-3-methylsulfonyl-N-(pyridin-3-ylmethyl)benzenesulfonamide

Systemtic Name: N-[1-(4-methoxypyrimidin-2-yl)piperidin-4-yl]-3-methylsulfonyl-N-(pyridin-3-ylmethyl)benzenesulfonamide Openeye Name: N-[1-(4-methoxypyrimidin-2-yl)-4-piperidyl]-3-methylsulfonyl-N-(3-pyridylmethyl)benzenesulfonamide CAS Name: N-[1-(4-methoxy-2-pyrimidinyl)-4-piperidinyl]-3-methylsulfonyl-N-(3-pyridinylmethyl)benzenesulfonamide IUPAC Name: N-[1-(4-methoxypyrimidin-2-yl)piperidin-4-yl]-3-methylsulfonyl-N-(pyridin-3-ylmethyl)benzenesulfonamide Traditional Name: 3-mesyl-N-[1-(4-methoxypyrimidin-2-yl)-4-piperidyl]-N-(3-pyridylmethyl)benzenesulfonamide Formula: C23H27N5O5S2 MolecularWeight: 517.62098

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC(=NC=C1)N2CCC(CC2)N(CC3=CN=CC=C3)S(=O)(=O)C4=CC=CC(=C4)S(=O)(=O)C

Isomeric SMILES

COC1=NC(=NC=C1)N2CCC(CC2)N(CC3=CN=CC=C3)S(=O)(=O)C4=CC=CC(=C4)S(=O)(=O)C

InChI

InChI=1S/C23H27N5O5S2/c1-33-22-8-12-25-23(26-22)27-13-9-19(10-14-27)28(17-18-5-4-11-24-16-18)35(31,32)21-7-3-6-20(15-21)34(2,29)30/h3-8,11-12,15-16,19H,9-10,13-14,17H2,1-2H3