2-[2-(3-bromanylthiophen-2-yl)-2-oxidanylidene-ethyl]sulfanyl-6-propyl-1H-pyrimidin-4-one

Systemtic Name: 2-[2-(3-bromanylthiophen-2-yl)-2-oxidanylidene-ethyl]sulfanyl-6-propyl-1H-pyrimidin-4-one Openeye Name: 2-[2-(3-bromo-2-thienyl)-2-oxo-ethyl]sulfanyl-6-propyl-1H-pyrimidin-4-one CAS Name: 2-[[2-(3-bromo-2-thiophenyl)-2-oxoethyl]thio]-6-propyl-1H-pyrimidin-4-one IUPAC Name: 2-[2-(3-bromothiophen-2-yl)-2-oxoethyl]sulfanyl-6-propyl-1H-pyrimidin-4-one Traditional Name: 2-[[2-(3-bromo-2-thienyl)-2-keto-ethyl]thio]-6-propyl-1H-pyrimidin-4-one Formula: C13H13BrN2O2S2 MolecularWeight: 373.28852

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=O)N=C(N1)SCC(=O)C2=C(C=CS2)Br

Isomeric SMILES

CCCC1=CC(=O)N=C(N1)SCC(=O)C2=C(C=CS2)Br

InChI

InChI=1S/C13H13BrN2O2S2/c1-2-3-8-6-11(18)16-13(15-8)20-7-10(17)12-9(14)4-5-19-12/h4-6H,2-3,7H2,1H3,(H,15,16,18)