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

Systemtic Name: 2-[(2R)-1-(4-methylphenyl)-1-oxidanylidene-propan-2-yl]sulfanyl-6-propyl-1H-pyrimidin-4-one Openeye Name: 2-[(1R)-1-methyl-2-oxo-2-(p-tolyl)ethyl]sulfanyl-6-propyl-1H-pyrimidin-4-one CAS Name: 2-[[(2R)-1-(4-methylphenyl)-1-oxopropan-2-yl]thio]-6-propyl-1H-pyrimidin-4-one IUPAC Name: 2-[(2R)-1-(4-methylphenyl)-1-oxopropan-2-yl]sulfanyl-6-propyl-1H-pyrimidin-4-one Traditional Name: 2-[[(1R)-2-keto-1-methyl-2-(p-tolyl)ethyl]thio]-6-propyl-1H-pyrimidin-4-one Formula: C17H20N2O2S MolecularWeight: 316.4179

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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)C

Isomeric SMILES

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

InChI

InChI=1S/C17H20N2O2S/c1-4-5-14-10-15(20)19-17(18-14)22-12(3)16(21)13-8-6-11(2)7-9-13/h6-10,12H,4-5H2,1-3H3,(H,18,19,20)/t12-/m1/s1