2-(4-methyl-6-pyrrolidin-1-ylsulfonyl-quinolin-2-yl)sulfanyl-N-(2-propan-2-ylphenyl)ethanamide

Systemtic Name: 2-(4-methyl-6-pyrrolidin-1-ylsulfonyl-quinolin-2-yl)sulfanyl-N-(2-propan-2-ylphenyl)ethanamide Openeye Name: N-(2-isopropylphenyl)-2-[(4-methyl-6-pyrrolidin-1-ylsulfonyl-2-quinolyl)sulfanyl]acetamide CAS Name: 2-[[4-methyl-6-(1-pyrrolidinylsulfonyl)-2-quinolinyl]thio]-N-(2-propan-2-ylphenyl)acetamide IUPAC Name: 2-(4-methyl-6-pyrrolidin-1-ylsulfonylquinolin-2-yl)sulfanyl-N-(2-propan-2-ylphenyl)acetamide Traditional Name: 2-[(4-methyl-6-pyrrolidinosulfonyl-2-quinolyl)thio]-N-o-cumenyl-acetamide Formula: C25H29N3O3S2 MolecularWeight: 483.64606

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=C1C=C(C=C2)S(=O)(=O)N3CCCC3)SCC(=O)NC4=CC=CC=C4C(C)C

Isomeric SMILES

CC1=CC(=NC2=C1C=C(C=C2)S(=O)(=O)N3CCCC3)SCC(=O)NC4=CC=CC=C4C(C)C

InChI

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