6-prop-2-enoyloxyhexyl 4-oxidanylidene-2-sulfanylidene-1H-pyrimidine-5-carboxylate

Systemtic Name: 6-prop-2-enoyloxyhexyl 4-oxidanylidene-2-sulfanylidene-1H-pyrimidine-5-carboxylate Openeye Name: 6-prop-2-enoyloxyhexyl 4-oxo-2-thioxo-1H-pyrimidine-5-carboxylate CAS Name: 4-oxo-2-sulfanylidene-1H-pyrimidine-5-carboxylic acid 6-(1-oxoprop-2-enoxy)hexyl ester IUPAC Name: 6-prop-2-enoyloxyhexyl 4-oxo-2-sulfanylidene-1H-pyrimidine-5-carboxylate Traditional Name: 4-keto-2-thioxo-1H-pyrimidine-5-carboxylic acid 6-acryloyloxyhexyl ester Formula: C14H18N2O5S MolecularWeight: 326.36812

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Descriptors Computed from Structure

Canonical SMILES:

C=CC(=O)OCCCCCCOC(=O)C1=CNC(=S)NC1=O

Isomeric SMILES

C=CC(=O)OCCCCCCOC(=O)C1=CNC(=S)NC1=O

InChI

InChI=1S/C14H18N2O5S/c1-2-11(17)20-7-5-3-4-6-8-21-13(19)10-9-15-14(22)16-12(10)18/h2,9H,1,3-8H2,(H2,15,16,18,22)