N-[1-(4,6-dimethylpyrimidin-2-yl)piperidin-4-yl]-N-(furan-2-ylmethyl)quinoline-8-sulfonamide

Systemtic Name: N-[1-(4,6-dimethylpyrimidin-2-yl)piperidin-4-yl]-N-(furan-2-ylmethyl)quinoline-8-sulfonamide Openeye Name: N-[1-(4,6-dimethylpyrimidin-2-yl)-4-piperidyl]-N-(2-furylmethyl)quinoline-8-sulfonamide CAS Name: N-[1-(4,6-dimethyl-2-pyrimidinyl)-4-piperidinyl]-N-(2-furanylmethyl)-8-quinolinesulfonamide IUPAC Name: N-[1-(4,6-dimethylpyrimidin-2-yl)piperidin-4-yl]-N-(furan-2-ylmethyl)quinoline-8-sulfonamide Traditional Name: N-[1-(4,6-dimethylpyrimidin-2-yl)-4-piperidyl]-N-(2-furfuryl)quinoline-8-sulfonamide Formula: C25H27N5O3S MolecularWeight: 477.57858

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)N2CCC(CC2)N(CC3=CC=CO3)S(=O)(=O)C4=CC=CC5=C4N=CC=C5)C

Isomeric SMILES

CC1=CC(=NC(=N1)N2CCC(CC2)N(CC3=CC=CO3)S(=O)(=O)C4=CC=CC5=C4N=CC=C5)C

InChI

InChI=1S/C25H27N5O3S/c1-18-16-19(2)28-25(27-18)29-13-10-21(11-14-29)30(17-22-8-5-15-33-22)34(31,32)23-9-3-6-20-7-4-12-26-24(20)23/h3-9,12,15-16,21H,10-11,13-14,17H2,1-2H3