ethyl 4-(1-methyl-6-oxidanylidene-4-propan-2-yl-pyrimidin-2-yl)sulfanylbutanoate

Systemtic Name: ethyl 4-(1-methyl-6-oxidanylidene-4-propan-2-yl-pyrimidin-2-yl)sulfanylbutanoate Openeye Name: ethyl 4-(4-isopropyl-1-methyl-6-oxo-pyrimidin-2-yl)sulfanylbutanoate CAS Name: 4-[(1-methyl-6-oxo-4-propan-2-yl-2-pyrimidinyl)thio]butanoic acid ethyl ester IUPAC Name: ethyl 4-(1-methyl-6-oxo-4-propan-2-ylpyrimidin-2-yl)sulfanylbutanoate Traditional Name: 4-[(4-isopropyl-6-keto-1-methyl-pyrimidin-2-yl)thio]butyric acid ethyl ester Formula: C14H22N2O3S MolecularWeight: 298.40108

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCSC1=NC(=CC(=O)N1C)C(C)C

Isomeric SMILES

CCOC(=O)CCCSC1=NC(=CC(=O)N1C)C(C)C

InChI

InChI=1S/C14H22N2O3S/c1-5-19-13(18)7-6-8-20-14-15-11(10(2)3)9-12(17)16(14)4/h9-10H,5-8H2,1-4H3