methyl 3-[(4-oxidanylidene-6-propyl-1H-pyrimidin-2-yl)sulfanyl]butanoate

Systemtic Name: methyl 3-[(4-oxidanylidene-6-propyl-1H-pyrimidin-2-yl)sulfanyl]butanoate Openeye Name: methyl 3-[(4-oxo-6-propyl-1H-pyrimidin-2-yl)sulfanyl]butanoate CAS Name: 3-[(4-oxo-6-propyl-1H-pyrimidin-2-yl)thio]butanoic acid methyl ester IUPAC Name: methyl 3-[(4-oxo-6-propyl-1H-pyrimidin-2-yl)sulfanyl]butanoate Traditional Name: 3-[(4-keto-6-propyl-1H-pyrimidin-2-yl)thio]butyric acid methyl ester Formula: C12H18N2O3S MolecularWeight: 270.34792

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=O)N=C(N1)SC(C)CC(=O)OC

Isomeric SMILES

CCCC1=CC(=O)N=C(N1)SC(C)CC(=O)OC

InChI

InChI=1S/C12H18N2O3S/c1-4-5-9-7-10(15)14-12(13-9)18-8(2)6-11(16)17-3/h7-8H,4-6H2,1-3H3,(H,13,14,15)