N-[1-(4-methoxypyrimidin-2-yl)piperidin-4-yl]-N-(pyridin-3-ylmethyl)quinoline-8-sulfonamide

Systemtic Name: N-[1-(4-methoxypyrimidin-2-yl)piperidin-4-yl]-N-(pyridin-3-ylmethyl)quinoline-8-sulfonamide Openeye Name: N-[1-(4-methoxypyrimidin-2-yl)-4-piperidyl]-N-(3-pyridylmethyl)quinoline-8-sulfonamide CAS Name: N-[1-(4-methoxy-2-pyrimidinyl)-4-piperidinyl]-N-(3-pyridinylmethyl)-8-quinolinesulfonamide IUPAC Name: N-[1-(4-methoxypyrimidin-2-yl)piperidin-4-yl]-N-(pyridin-3-ylmethyl)quinoline-8-sulfonamide Traditional Name: N-[1-(4-methoxypyrimidin-2-yl)-4-piperidyl]-N-(3-pyridylmethyl)quinoline-8-sulfonamide Formula: C25H26N6O3S MolecularWeight: 490.57734

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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=CC5=C4N=CC=C5

Isomeric SMILES

COC1=NC(=NC=C1)N2CCC(CC2)N(CC3=CN=CC=C3)S(=O)(=O)C4=CC=CC5=C4N=CC=C5

InChI

InChI=1S/C25H26N6O3S/c1-34-23-9-14-28-25(29-23)30-15-10-21(11-16-30)31(18-19-5-3-12-26-17-19)35(32,33)22-8-2-6-20-7-4-13-27-24(20)22/h2-9,12-14,17,21H,10-11,15-16,18H2,1H3