2-[8-(4-chlorophenyl)-8-oxidanylidene-octyl]sulfanyl-1-methyl-pyrimidin-4-one

Systemtic Name: 2-[8-(4-chlorophenyl)-8-oxidanylidene-octyl]sulfanyl-1-methyl-pyrimidin-4-one Openeye Name: 2-[8-(4-chlorophenyl)-8-oxo-octyl]sulfanyl-1-methyl-pyrimidin-4-one CAS Name: 2-[[8-(4-chlorophenyl)-8-oxooctyl]thio]-1-methyl-4-pyrimidinone IUPAC Name: 2-[8-(4-chlorophenyl)-8-oxooctyl]sulfanyl-1-methylpyrimidin-4-one Traditional Name: 2-[[8-(4-chlorophenyl)-8-keto-octyl]thio]-1-methyl-pyrimidin-4-one Formula: C19H23ClN2O2S MolecularWeight: 378.91612

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC(=O)N=C1SCCCCCCCC(=O)C2=CC=C(C=C2)Cl

Isomeric SMILES

CN1C=CC(=O)N=C1SCCCCCCCC(=O)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C19H23ClN2O2S/c1-22-13-12-18(24)21-19(22)25-14-6-4-2-3-5-7-17(23)15-8-10-16(20)11-9-15/h8-13H,2-7,14H2,1H3