2-[(2R)-1-(4-ethoxyphenyl)-1-oxidanylidene-propan-2-yl]sulfanyl-6-propyl-1H-pyrimidin-4-one

Systemtic Name: 2-[(2R)-1-(4-ethoxyphenyl)-1-oxidanylidene-propan-2-yl]sulfanyl-6-propyl-1H-pyrimidin-4-one Openeye Name: 2-[(1R)-2-(4-ethoxyphenyl)-1-methyl-2-oxo-ethyl]sulfanyl-6-propyl-1H-pyrimidin-4-one CAS Name: 2-[[(2R)-1-(4-ethoxyphenyl)-1-oxopropan-2-yl]thio]-6-propyl-1H-pyrimidin-4-one IUPAC Name: 2-[(2R)-1-(4-ethoxyphenyl)-1-oxopropan-2-yl]sulfanyl-6-propyl-1H-pyrimidin-4-one Traditional Name: 2-[[(1R)-2-keto-1-methyl-2-p-phenetyl-ethyl]thio]-6-propyl-1H-pyrimidin-4-one Formula: C18H22N2O3S MolecularWeight: 346.44388

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=O)N=C(N1)SC(C)C(=O)C2=CC=C(C=C2)OCC

Isomeric SMILES

CCCC1=CC(=O)N=C(N1)S[C@H](C)C(=O)C2=CC=C(C=C2)OCC

InChI

InChI=1S/C18H22N2O3S/c1-4-6-14-11-16(21)20-18(19-14)24-12(3)17(22)13-7-9-15(10-8-13)23-5-2/h7-12H,4-6H2,1-3H3,(H,19,20,21)/t12-/m1/s1