2-(7-methoxy-4-phenyl-quinolin-2-yl)sulfanyl-1-pyrrolidin-1-yl-ethanone

Systemtic Name: 2-(7-methoxy-4-phenyl-quinolin-2-yl)sulfanyl-1-pyrrolidin-1-yl-ethanone Openeye Name: 2-[(7-methoxy-4-phenyl-2-quinolyl)sulfanyl]-1-pyrrolidin-1-yl-ethanone CAS Name: 2-[(7-methoxy-4-phenyl-2-quinolinyl)thio]-1-(1-pyrrolidinyl)ethanone IUPAC Name: 2-(7-methoxy-4-phenylquinolin-2-yl)sulfanyl-1-pyrrolidin-1-ylethanone Traditional Name: 2-[(7-methoxy-4-phenyl-2-quinolyl)thio]-1-pyrrolidino-ethanone Formula: C22H22N2O2S MolecularWeight: 378.48728

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=CC(=N2)SCC(=O)N3CCCC3)C4=CC=CC=C4

Isomeric SMILES

COC1=CC2=C(C=C1)C(=CC(=N2)SCC(=O)N3CCCC3)C4=CC=CC=C4

InChI

InChI=1S/C22H22N2O2S/c1-26-17-9-10-18-19(16-7-3-2-4-8-16)14-21(23-20(18)13-17)27-15-22(25)24-11-5-6-12-24/h2-4,7-10,13-14H,5-6,11-12,15H2,1H3