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

Systemtic Name: 2-[4-methyl-6-(4-methylpiperidin-1-yl)sulfonyl-quinolin-2-yl]sulfanyl-N-phenyl-propanamide Openeye Name: 2-[[4-methyl-6-[(4-methyl-1-piperidyl)sulfonyl]-2-quinolyl]sulfanyl]-N-phenyl-propanamide CAS Name: 2-[[4-methyl-6-[(4-methyl-1-piperidinyl)sulfonyl]-2-quinolinyl]thio]-N-phenylpropanamide IUPAC Name: 2-[4-methyl-6-(4-methylpiperidin-1-yl)sulfonylquinolin-2-yl]sulfanyl-N-phenylpropanamide Traditional Name: 2-[[4-methyl-6-(4-methylpiperidino)sulfonyl-2-quinolyl]thio]-N-phenyl-propionamide 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)SC(C)C(=O)NC4=CC=CC=C4

Isomeric SMILES

CC1CCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)N=C(C=C3C)SC(C)C(=O)NC4=CC=CC=C4

InChI

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