1-[(2R)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrrolidin-1-yl]-2-(4-methylquinolin-2-yl)sulfanyl-ethanone

Systemtic Name: 1-[(2R)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrrolidin-1-yl]-2-(4-methylquinolin-2-yl)sulfanyl-ethanone Openeye Name: 1-[(2R)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrrolidin-1-yl]-2-[(4-methyl-2-quinolyl)sulfanyl]ethanone CAS Name: 1-[(2R)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-pyrrolidinyl]-2-[(4-methyl-2-quinolinyl)thio]ethanone IUPAC Name: 1-[(2R)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrrolidin-1-yl]-2-(4-methylquinolin-2-yl)sulfanylethanone Traditional Name: 1-[(2R)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrrolidino]-2-[(4-methyl-2-quinolyl)thio]ethanone Formula: C24H24N2O3S MolecularWeight: 420.52396

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=CC=CC=C12)SCC(=O)N3CCCC3C4=CC5=C(C=C4)OCCO5

Isomeric SMILES

CC1=CC(=NC2=CC=CC=C12)SCC(=O)N3CCC[C@@H]3C4=CC5=C(C=C4)OCCO5

InChI

InChI=1S/C24H24N2O3S/c1-16-13-23(25-19-6-3-2-5-18(16)19)30-15-24(27)26-10-4-7-20(26)17-8-9-21-22(14-17)29-12-11-28-21/h2-3,5-6,8-9,13-14,20H,4,7,10-12,15H2,1H3/t20-/m1/s1