2-(4,8-dimethylquinolin-2-yl)sulfanyl-1-(5-pyrrolidin-1-ylcarbonyl-1H-pyrrol-3-yl)ethanone

Systemtic Name: 2-(4,8-dimethylquinolin-2-yl)sulfanyl-1-(5-pyrrolidin-1-ylcarbonyl-1H-pyrrol-3-yl)ethanone Openeye Name: 2-[(4,8-dimethyl-2-quinolyl)sulfanyl]-1-[5-(pyrrolidine-1-carbonyl)-1H-pyrrol-3-yl]ethanone CAS Name: 2-[(4,8-dimethyl-2-quinolinyl)thio]-1-[5-[oxo(1-pyrrolidinyl)methyl]-1H-pyrrol-3-yl]ethanone IUPAC Name: 2-(4,8-dimethylquinolin-2-yl)sulfanyl-1-[5-(pyrrolidine-1-carbonyl)-1H-pyrrol-3-yl]ethanone Traditional Name: 2-[(4,8-dimethyl-2-quinolyl)thio]-1-[5-(pyrrolidine-1-carbonyl)-1H-pyrrol-3-yl]ethanone Formula: C22H23N3O2S MolecularWeight: 393.50192

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1N=C(C=C2C)SCC(=O)C3=CNC(=C3)C(=O)N4CCCC4

Isomeric SMILES

CC1=CC=CC2=C1N=C(C=C2C)SCC(=O)C3=CNC(=C3)C(=O)N4CCCC4

InChI

InChI=1S/C22H23N3O2S/c1-14-6-5-7-17-15(2)10-20(24-21(14)17)28-13-19(26)16-11-18(23-12-16)22(27)25-8-3-4-9-25/h5-7,10-12,23H,3-4,8-9,13H2,1-2H3