2-[4-methyl-6-(4-methylpiperidin-1-yl)sulfonyl-quinolin-2-yl]sulfanyl-N-(2-methylphenyl)ethanamide

Systemtic Name: 2-[4-methyl-6-(4-methylpiperidin-1-yl)sulfonyl-quinolin-2-yl]sulfanyl-N-(2-methylphenyl)ethanamide Openeye Name: 2-[[4-methyl-6-[(4-methyl-1-piperidyl)sulfonyl]-2-quinolyl]sulfanyl]-N-(o-tolyl)acetamide CAS Name: 2-[[4-methyl-6-[(4-methyl-1-piperidinyl)sulfonyl]-2-quinolinyl]thio]-N-(2-methylphenyl)acetamide IUPAC Name: 2-[4-methyl-6-(4-methylpiperidin-1-yl)sulfonylquinolin-2-yl]sulfanyl-N-(2-methylphenyl)acetamide Traditional Name: 2-[[4-methyl-6-(4-methylpiperidino)sulfonyl-2-quinolyl]thio]-N-(o-tolyl)acetamide Formula: C25H29N3O3S2 MolecularWeight: 483.64606

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)N=C(C=C3C)SCC(=O)NC4=CC=CC=C4C

Isomeric SMILES

CC1CCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)N=C(C=C3C)SCC(=O)NC4=CC=CC=C4C

InChI

InChI=1S/C25H29N3O3S2/c1-17-10-12-28(13-11-17)33(30,31)20-8-9-23-21(15-20)19(3)14-25(27-23)32-16-24(29)26-22-7-5-4-6-18(22)2/h4-9,14-15,17H,10-13,16H2,1-3H3,(H,26,29)