1-(4-ethanoyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-(3-methylquinoxalin-2-yl)sulfanyl-ethanone

Systemtic Name: 1-(4-ethanoyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-(3-methylquinoxalin-2-yl)sulfanyl-ethanone Openeye Name: 1-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-(3-methylquinoxalin-2-yl)sulfanyl-ethanone CAS Name: 1-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-[(3-methyl-2-quinoxalinyl)thio]ethanone IUPAC Name: 1-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-(3-methylquinoxalin-2-yl)sulfanylethanone Traditional Name: 1-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-[(3-methylquinoxalin-2-yl)thio]ethanone Formula: C19H19N3O2S MolecularWeight: 353.43806

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1C(=O)C)C)C(=O)CSC2=NC3=CC=CC=C3N=C2C

Isomeric SMILES

CC1=C(NC(=C1C(=O)C)C)C(=O)CSC2=NC3=CC=CC=C3N=C2C

InChI

InChI=1S/C19H19N3O2S/c1-10-17(13(4)23)11(2)21-18(10)16(24)9-25-19-12(3)20-14-7-5-6-8-15(14)22-19/h5-8,21H,9H2,1-4H3