4-[(3-cyanophenyl)amino]-6-[1-(furan-2-ylcarbonyl)piperidin-4-yl]sulfonyl-8-methyl-quinoline-3-carboxamide

Systemtic Name: 4-[(3-cyanophenyl)amino]-6-[1-(furan-2-ylcarbonyl)piperidin-4-yl]sulfonyl-8-methyl-quinoline-3-carboxamide Openeye Name: 4-(3-cyanoanilino)-6-[[1-(furan-2-carbonyl)-4-piperidyl]sulfonyl]-8-methyl-quinoline-3-carboxamide CAS Name: 4-(3-cyanoanilino)-6-[[1-[2-furanyl(oxo)methyl]-4-piperidinyl]sulfonyl]-8-methyl-3-quinolinecarboxamide IUPAC Name: 4-(3-cyanoanilino)-6-[1-(furan-2-carbonyl)piperidin-4-yl]sulfonyl-8-methylquinoline-3-carboxamide Traditional Name: 4-(3-cyanoanilino)-6-[[1-(2-furoyl)-4-piperidyl]sulfonyl]-8-methyl-quinoline-3-carboxamide Formula: C28H25N5O5S MolecularWeight: 543.5936

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC(=C1)S(=O)(=O)C3CCN(CC3)C(=O)C4=CC=CO4)C(=C(C=N2)C(=O)N)NC5=CC=CC(=C5)C#N

Isomeric SMILES

CC1=C2C(=CC(=C1)S(=O)(=O)C3CCN(CC3)C(=O)C4=CC=CO4)C(=C(C=N2)C(=O)N)NC5=CC=CC(=C5)C#N

InChI

InChI=1S/C28H25N5O5S/c1-17-12-21(39(36,37)20-7-9-33(10-8-20)28(35)24-6-3-11-38-24)14-22-25(17)31-16-23(27(30)34)26(22)32-19-5-2-4-18(13-19)15-29/h2-6,11-14,16,20H,7-10H2,1H3,(H2,30,34)(H,31,32)