2-[2-[2,5-bis(chloranyl)thiophen-3-yl]-2-oxidanylidene-ethyl]sulfanyl-6-propyl-1H-pyrimidin-4-one

Systemtic Name: 2-[2-[2,5-bis(chloranyl)thiophen-3-yl]-2-oxidanylidene-ethyl]sulfanyl-6-propyl-1H-pyrimidin-4-one Openeye Name: 2-[2-(2,5-dichloro-3-thienyl)-2-oxo-ethyl]sulfanyl-6-propyl-1H-pyrimidin-4-one CAS Name: 2-[[2-(2,5-dichloro-3-thiophenyl)-2-oxoethyl]thio]-6-propyl-1H-pyrimidin-4-one IUPAC Name: 2-[2-(2,5-dichlorothiophen-3-yl)-2-oxoethyl]sulfanyl-6-propyl-1H-pyrimidin-4-one Traditional Name: 2-[[2-(2,5-dichloro-3-thienyl)-2-keto-ethyl]thio]-6-propyl-1H-pyrimidin-4-one Formula: C13H12Cl2N2O2S2 MolecularWeight: 363.28258

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=O)N=C(N1)SCC(=O)C2=C(SC(=C2)Cl)Cl

Isomeric SMILES

CCCC1=CC(=O)N=C(N1)SCC(=O)C2=C(SC(=C2)Cl)Cl

InChI

InChI=1S/C13H12Cl2N2O2S2/c1-2-3-7-4-11(19)17-13(16-7)20-6-9(18)8-5-10(14)21-12(8)15/h4-5H,2-3,6H2,1H3,(H,16,17,19)