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

Systemtic Name: 2-[2-oxidanylidene-2-(2,4,5-trimethylphenyl)ethyl]sulfanyl-6-propyl-1H-pyrimidin-4-one Openeye Name: 2-[2-oxo-2-(2,4,5-trimethylphenyl)ethyl]sulfanyl-6-propyl-1H-pyrimidin-4-one CAS Name: 2-[[2-oxo-2-(2,4,5-trimethylphenyl)ethyl]thio]-6-propyl-1H-pyrimidin-4-one IUPAC Name: 2-[2-oxo-2-(2,4,5-trimethylphenyl)ethyl]sulfanyl-6-propyl-1H-pyrimidin-4-one Traditional Name: 2-[[2-keto-2-(2,4,5-trimethylphenyl)ethyl]thio]-6-propyl-1H-pyrimidin-4-one Formula: C18H22N2O2S MolecularWeight: 330.44448

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=O)N=C(N1)SCC(=O)C2=CC(=C(C=C2C)C)C

Isomeric SMILES

CCCC1=CC(=O)N=C(N1)SCC(=O)C2=CC(=C(C=C2C)C)C

InChI

InChI=1S/C18H22N2O2S/c1-5-6-14-9-17(22)20-18(19-14)23-10-16(21)15-8-12(3)11(2)7-13(15)4/h7-9H,5-6,10H2,1-4H3,(H,19,20,22)