1-(3-methylsulfanylphenyl)-4-[(6-pyrrolidin-1-ylsulfonyl-3,4-dihydro-2H-quinolin-1-yl)carbonyl]pyrrolidin-2-one

Systemtic Name: 1-(3-methylsulfanylphenyl)-4-[(6-pyrrolidin-1-ylsulfonyl-3,4-dihydro-2H-quinolin-1-yl)carbonyl]pyrrolidin-2-one Openeye Name: 1-(3-methylsulfanylphenyl)-4-(6-pyrrolidin-1-ylsulfonyl-3,4-dihydro-2H-quinoline-1-carbonyl)pyrrolidin-2-one CAS Name: 1-[3-(methylthio)phenyl]-4-[oxo-[6-(1-pyrrolidinylsulfonyl)-3,4-dihydro-2H-quinolin-1-yl]methyl]-2-pyrrolidinone IUPAC Name: 1-(3-methylsulfanylphenyl)-4-(6-pyrrolidin-1-ylsulfonyl-3,4-dihydro-2H-quinoline-1-carbonyl)pyrrolidin-2-one Traditional Name: 1-[3-(methylthio)phenyl]-4-(6-pyrrolidinosulfonyl-3,4-dihydro-2H-quinoline-1-carbonyl)-2-pyrrolidone Formula: C25H29N3O4S2 MolecularWeight: 499.64546

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC(=C1)N2CC(CC2=O)C(=O)N3CCCC4=C3C=CC(=C4)S(=O)(=O)N5CCCC5

Isomeric SMILES

CSC1=CC=CC(=C1)N2CC(CC2=O)C(=O)N3CCCC4=C3C=CC(=C4)S(=O)(=O)N5CCCC5

InChI

InChI=1S/C25H29N3O4S2/c1-33-21-8-4-7-20(16-21)28-17-19(15-24(28)29)25(30)27-13-5-6-18-14-22(9-10-23(18)27)34(31,32)26-11-2-3-12-26/h4,7-10,14,16,19H,2-3,5-6,11-13,15,17H2,1H3