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

Systemtic Name: 2-[2-(2-chlorophenyl)-2-oxidanylidene-ethyl]sulfanyl-6-propyl-1H-pyrimidin-4-one Openeye Name: 2-[2-(2-chlorophenyl)-2-oxo-ethyl]sulfanyl-6-propyl-1H-pyrimidin-4-one CAS Name: 2-[[2-(2-chlorophenyl)-2-oxoethyl]thio]-6-propyl-1H-pyrimidin-4-one IUPAC Name: 2-[2-(2-chlorophenyl)-2-oxoethyl]sulfanyl-6-propyl-1H-pyrimidin-4-one Traditional Name: 2-[[2-(2-chlorophenyl)-2-keto-ethyl]thio]-6-propyl-1H-pyrimidin-4-one Formula: C15H15ClN2O2S MolecularWeight: 322.8098

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=O)N=C(N1)SCC(=O)C2=CC=CC=C2Cl

Isomeric SMILES

CCCC1=CC(=O)N=C(N1)SCC(=O)C2=CC=CC=C2Cl

InChI

InChI=1S/C15H15ClN2O2S/c1-2-5-10-8-14(20)18-15(17-10)21-9-13(19)11-6-3-4-7-12(11)16/h3-4,6-8H,2,5,9H2,1H3,(H,17,18,20)