ethyl 6-methyl-2-oxidanylidene-4-[(E)-2-oxidanyl-4-oxidanylidene-pent-2-en-3-yl]sulfanyl-1H-pyrimidine-5-carboxylate

Systemtic Name: ethyl 6-methyl-2-oxidanylidene-4-[(E)-2-oxidanyl-4-oxidanylidene-pent-2-en-3-yl]sulfanyl-1H-pyrimidine-5-carboxylate Openeye Name: ethyl 4-[(E)-1-acetyl-2-hydroxy-prop-1-enyl]sulfanyl-6-methyl-2-oxo-1H-pyrimidine-5-carboxylate CAS Name: 4-[[(E)-2-hydroxy-4-oxopent-2-en-3-yl]thio]-6-methyl-2-oxo-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 4-[(E)-2-hydroxy-4-oxopent-2-en-3-yl]sulfanyl-6-methyl-2-oxo-1H-pyrimidine-5-carboxylate Traditional Name: 4-[[(E)-1-acetyl-2-hydroxy-prop-1-enyl]thio]-2-keto-6-methyl-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C13H16N2O5S MolecularWeight: 312.34154

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=O)N=C1SC(=C(C)O)C(=O)C)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=O)N=C1S/C(=C(\C)/O)/C(=O)C)C

InChI

InChI=1S/C13H16N2O5S/c1-5-20-12(18)9-6(2)14-13(19)15-11(9)21-10(7(3)16)8(4)17/h16H,5H2,1-4H3,(H,14,15,19)/b10-7+