6-(2-methylprop-2-enoyloxy)hexyl 4-oxidanylidene-6-phenyl-2-sulfanylidene-1H-pyrimidine-5-carboxylate

Systemtic Name: 6-(2-methylprop-2-enoyloxy)hexyl 4-oxidanylidene-6-phenyl-2-sulfanylidene-1H-pyrimidine-5-carboxylate Openeye Name: 6-(2-methylprop-2-enoyloxy)hexyl 4-oxo-6-phenyl-2-thioxo-1H-pyrimidine-5-carboxylate CAS Name: 4-oxo-6-phenyl-2-sulfanylidene-1H-pyrimidine-5-carboxylic acid 6-(2-methyl-1-oxoprop-2-enoxy)hexyl ester IUPAC Name: 6-(2-methylprop-2-enoyloxy)hexyl 4-oxo-6-phenyl-2-sulfanylidene-1H-pyrimidine-5-carboxylate Traditional Name: 4-keto-6-phenyl-2-thioxo-1H-pyrimidine-5-carboxylic acid 6-methacryloyloxyhexyl ester Formula: C21H24N2O5S MolecularWeight: 416.49066

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)C(=O)OCCCCCCOC(=O)C1=C(NC(=S)NC1=O)C2=CC=CC=C2

Isomeric SMILES

CC(=C)C(=O)OCCCCCCOC(=O)C1=C(NC(=S)NC1=O)C2=CC=CC=C2

InChI

InChI=1S/C21H24N2O5S/c1-14(2)19(25)27-12-8-3-4-9-13-28-20(26)16-17(15-10-6-5-7-11-15)22-21(29)23-18(16)24/h5-7,10-11H,1,3-4,8-9,12-13H2,2H3,(H2,22,23,24,29)