1-(4-ethanoyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-quinolin-2-ylsulfanyl-ethanone

Systemtic Name: 1-(4-ethanoyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-quinolin-2-ylsulfanyl-ethanone Openeye Name: 1-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-(2-quinolylsulfanyl)ethanone CAS Name: 1-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-(2-quinolinylthio)ethanone IUPAC Name: 1-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-quinolin-2-ylsulfanylethanone Traditional Name: 1-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-(2-quinolylthio)ethanone Formula: C19H18N2O2S MolecularWeight: 338.42342

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1C(=O)C)C)C(=O)CSC2=NC3=CC=CC=C3C=C2

Isomeric SMILES

CC1=C(NC(=C1C(=O)C)C)C(=O)CSC2=NC3=CC=CC=C3C=C2

InChI

InChI=1S/C19H18N2O2S/c1-11-18(13(3)22)12(2)20-19(11)16(23)10-24-17-9-8-14-6-4-5-7-15(14)21-17/h4-9,20H,10H2,1-3H3