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

Systemtic Name: N-[1-(4-methoxypyrimidin-2-yl)piperidin-4-yl]-4-methylsulfonyl-N-(pyridin-3-ylmethyl)benzamide Openeye Name: N-[1-(4-methoxypyrimidin-2-yl)-4-piperidyl]-4-methylsulfonyl-N-(3-pyridylmethyl)benzamide CAS Name: N-[1-(4-methoxy-2-pyrimidinyl)-4-piperidinyl]-4-methylsulfonyl-N-(3-pyridinylmethyl)benzamide IUPAC Name: N-[1-(4-methoxypyrimidin-2-yl)piperidin-4-yl]-4-methylsulfonyl-N-(pyridin-3-ylmethyl)benzamide Traditional Name: 4-mesyl-N-[1-(4-methoxypyrimidin-2-yl)-4-piperidyl]-N-(3-pyridylmethyl)benzamide Formula: C24H27N5O4S MolecularWeight: 481.56728

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H27N5O4S/c1-33-22-9-13-26-24(27-22)28-14-10-20(11-15-28)29(17-18-4-3-12-25-16-18)23(30)19-5-7-21(8-6-19)34(2,31)32/h3-9,12-13,16,20H,10-11,14-15,17H2,1-2H3