1-[1-[1,1-bis(oxidanylidene)thiolan-3-yl]-2,5-dimethyl-pyrrol-3-yl]-2-pyridin-2-ylsulfanyl-ethanone

Systemtic Name: 1-[1-[1,1-bis(oxidanylidene)thiolan-3-yl]-2,5-dimethyl-pyrrol-3-yl]-2-pyridin-2-ylsulfanyl-ethanone Openeye Name: 1-[1-(1,1-dioxothiolan-3-yl)-2,5-dimethyl-pyrrol-3-yl]-2-(2-pyridylsulfanyl)ethanone CAS Name: 1-[1-(1,1-dioxo-3-thiolanyl)-2,5-dimethyl-3-pyrrolyl]-2-(2-pyridinylthio)ethanone IUPAC Name: 1-[1-(1,1-dioxothiolan-3-yl)-2,5-dimethylpyrrol-3-yl]-2-pyridin-2-ylsulfanylethanone Traditional Name: 1-[1-(1,1-diketothiolan-3-yl)-2,5-dimethyl-pyrrol-3-yl]-2-(2-pyridylthio)ethanone Formula: C17H20N2O3S2 MolecularWeight: 364.4823

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2CCS(=O)(=O)C2)C)C(=O)CSC3=CC=CC=N3

Isomeric SMILES

CC1=CC(=C(N1C2CCS(=O)(=O)C2)C)C(=O)CSC3=CC=CC=N3

InChI

InChI=1S/C17H20N2O3S2/c1-12-9-15(16(20)10-23-17-5-3-4-7-18-17)13(2)19(12)14-6-8-24(21,22)11-14/h3-5,7,9,14H,6,8,10-11H2,1-2H3