2-[2-(4-chlorophenyl)-2-oxidanylidene-ethyl]sulfanyl-6-ethyl-1H-pyrimidin-4-one

Systemtic Name: 2-[2-(4-chlorophenyl)-2-oxidanylidene-ethyl]sulfanyl-6-ethyl-1H-pyrimidin-4-one Openeye Name: 2-[2-(4-chlorophenyl)-2-oxo-ethyl]sulfanyl-6-ethyl-1H-pyrimidin-4-one CAS Name: 2-[[2-(4-chlorophenyl)-2-oxoethyl]thio]-6-ethyl-1H-pyrimidin-4-one IUPAC Name: 2-[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl-6-ethyl-1H-pyrimidin-4-one Traditional Name: 2-[[2-(4-chlorophenyl)-2-keto-ethyl]thio]-6-ethyl-1H-pyrimidin-4-one Formula: C14H13ClN2O2S MolecularWeight: 308.78322

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=O)N=C(N1)SCC(=O)C2=CC=C(C=C2)Cl

Isomeric SMILES

CCC1=CC(=O)N=C(N1)SCC(=O)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C14H13ClN2O2S/c1-2-11-7-13(19)17-14(16-11)20-8-12(18)9-3-5-10(15)6-4-9/h3-7H,2,8H2,1H3,(H,16,17,19)