2-[2-(5-chloranylthiophen-2-yl)-2-oxidanylidene-ethyl]sulfanyl-6-propyl-1H-pyrimidin-4-one

Systemtic Name: 2-[2-(5-chloranylthiophen-2-yl)-2-oxidanylidene-ethyl]sulfanyl-6-propyl-1H-pyrimidin-4-one Openeye Name: 2-[2-(5-chloro-2-thienyl)-2-oxo-ethyl]sulfanyl-6-propyl-1H-pyrimidin-4-one CAS Name: 2-[[2-(5-chloro-2-thiophenyl)-2-oxoethyl]thio]-6-propyl-1H-pyrimidin-4-one IUPAC Name: 2-[2-(5-chlorothiophen-2-yl)-2-oxoethyl]sulfanyl-6-propyl-1H-pyrimidin-4-one Traditional Name: 2-[[2-(5-chloro-2-thienyl)-2-keto-ethyl]thio]-6-propyl-1H-pyrimidin-4-one Formula: C13H13ClN2O2S2 MolecularWeight: 328.83752

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=O)N=C(N1)SCC(=O)C2=CC=C(S2)Cl

Isomeric SMILES

CCCC1=CC(=O)N=C(N1)SCC(=O)C2=CC=C(S2)Cl

InChI

InChI=1S/C13H13ClN2O2S2/c1-2-3-8-6-12(18)16-13(15-8)19-7-9(17)10-4-5-11(14)20-10/h4-6H,2-3,7H2,1H3,(H,15,16,18)