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

Systemtic Name: 1-(2,5-dimethyl-1H-pyrrol-3-yl)-2-quinolin-2-ylsulfanyl-ethanone Openeye Name: 1-(2,5-dimethyl-1H-pyrrol-3-yl)-2-(2-quinolylsulfanyl)ethanone CAS Name: 1-(2,5-dimethyl-1H-pyrrol-3-yl)-2-(2-quinolinylthio)ethanone IUPAC Name: 1-(2,5-dimethyl-1H-pyrrol-3-yl)-2-quinolin-2-ylsulfanylethanone Traditional Name: 1-(2,5-dimethyl-1H-pyrrol-3-yl)-2-(2-quinolylthio)ethanone Formula: C17H16N2OS MolecularWeight: 296.38674

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1)C)C(=O)CSC2=NC3=CC=CC=C3C=C2

Isomeric SMILES

CC1=CC(=C(N1)C)C(=O)CSC2=NC3=CC=CC=C3C=C2

InChI

InChI=1S/C17H16N2OS/c1-11-9-14(12(2)18-11)16(20)10-21-17-8-7-13-5-3-4-6-15(13)19-17/h3-9,18H,10H2,1-2H3