2-(4-methyl-6-pyrrolidin-1-ylsulfonyl-quinolin-2-yl)sulfanyl-N-phenyl-propanamide

Systemtic Name: 2-(4-methyl-6-pyrrolidin-1-ylsulfonyl-quinolin-2-yl)sulfanyl-N-phenyl-propanamide Openeye Name: 2-[(4-methyl-6-pyrrolidin-1-ylsulfonyl-2-quinolyl)sulfanyl]-N-phenyl-propanamide CAS Name: 2-[[4-methyl-6-(1-pyrrolidinylsulfonyl)-2-quinolinyl]thio]-N-phenylpropanamide IUPAC Name: 2-(4-methyl-6-pyrrolidin-1-ylsulfonylquinolin-2-yl)sulfanyl-N-phenylpropanamide Traditional Name: 2-[(4-methyl-6-pyrrolidinosulfonyl-2-quinolyl)thio]-N-phenyl-propionamide Formula: C23H25N3O3S2 MolecularWeight: 455.5929

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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)NC4=CC=CC=C4

Isomeric SMILES

CC1=CC(=NC2=C1C=C(C=C2)S(=O)(=O)N3CCCC3)SC(C)C(=O)NC4=CC=CC=C4

InChI

InChI=1S/C23H25N3O3S2/c1-16-14-22(30-17(2)23(27)24-18-8-4-3-5-9-18)25-21-11-10-19(15-20(16)21)31(28,29)26-12-6-7-13-26/h3-5,8-11,14-15,17H,6-7,12-13H2,1-2H3,(H,24,27)