propyl 2-[(5-cyano-6-ethyl-4-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]ethanoate

Systemtic Name: propyl 2-[(5-cyano-6-ethyl-4-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]ethanoate Openeye Name: propyl 2-[(5-cyano-6-ethyl-4-oxo-1H-pyrimidin-2-yl)sulfanyl]acetate CAS Name: 2-[(5-cyano-6-ethyl-4-oxo-1H-pyrimidin-2-yl)thio]acetic acid propyl ester IUPAC Name: propyl 2-[(5-cyano-6-ethyl-4-oxo-1H-pyrimidin-2-yl)sulfanyl]acetate Traditional Name: 2-[(5-cyano-6-ethyl-4-keto-1H-pyrimidin-2-yl)thio]acetic acid propyl ester Formula: C12H15N3O3S MolecularWeight: 281.3308

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)CSC1=NC(=O)C(=C(N1)CC)C#N

Isomeric SMILES

CCCOC(=O)CSC1=NC(=O)C(=C(N1)CC)C#N

InChI

InChI=1S/C12H15N3O3S/c1-3-5-18-10(16)7-19-12-14-9(4-2)8(6-13)11(17)15-12/h3-5,7H2,1-2H3,(H,14,15,17)