1-(2,3-dihydroindol-1-yl)-2-(4-methyl-6-pyrrolidin-1-ylsulfonyl-quinolin-2-yl)sulfanyl-propan-1-one

Systemtic Name: 1-(2,3-dihydroindol-1-yl)-2-(4-methyl-6-pyrrolidin-1-ylsulfonyl-quinolin-2-yl)sulfanyl-propan-1-one Openeye Name: 1-indolin-1-yl-2-[(4-methyl-6-pyrrolidin-1-ylsulfonyl-2-quinolyl)sulfanyl]propan-1-one CAS Name: 1-(2,3-dihydroindol-1-yl)-2-[[4-methyl-6-(1-pyrrolidinylsulfonyl)-2-quinolinyl]thio]-1-propanone IUPAC Name: 1-(2,3-dihydroindol-1-yl)-2-(4-methyl-6-pyrrolidin-1-ylsulfonylquinolin-2-yl)sulfanylpropan-1-one Traditional Name: 1-indolin-1-yl-2-[(4-methyl-6-pyrrolidinosulfonyl-2-quinolyl)thio]propan-1-one Formula: C25H27N3O3S2 MolecularWeight: 481.63018

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=C1C=C(C=C2)S(=O)(=O)N3CCCC3)SC(C)C(=O)N4CCC5=CC=CC=C54

Isomeric SMILES

CC1=CC(=NC2=C1C=C(C=C2)S(=O)(=O)N3CCCC3)SC(C)C(=O)N4CCC5=CC=CC=C54

InChI

InChI=1S/C25H27N3O3S2/c1-17-15-24(32-18(2)25(29)28-14-11-19-7-3-4-8-23(19)28)26-22-10-9-20(16-21(17)22)33(30,31)27-12-5-6-13-27/h3-4,7-10,15-16,18H,5-6,11-14H2,1-2H3