methyl 4-[4-(furan-2-ylcarbonyloxy)phenyl]-6-methylidene-2-sulfanylidene-1,3-diazinane-5-carboxylate

Systemtic Name: methyl 4-[4-(furan-2-ylcarbonyloxy)phenyl]-6-methylidene-2-sulfanylidene-1,3-diazinane-5-carboxylate Openeye Name: methyl 4-[4-(furan-2-carbonyloxy)phenyl]-6-methylene-2-thioxo-hexahydropyrimidine-5-carboxylate CAS Name: 4-[4-[2-furanyl(oxo)methoxy]phenyl]-6-methylene-2-sulfanylidene-1,3-diazinane-5-carboxylic acid methyl ester IUPAC Name: methyl 4-[4-(furan-2-carbonyloxy)phenyl]-6-methylidene-2-sulfanylidene-1,3-diazinane-5-carboxylate Traditional Name: 4-[4-(2-furoyloxy)phenyl]-6-methylene-2-thioxo-hexahydropyrimidine-5-carboxylic acid methyl ester Formula: C18H16N2O5S MolecularWeight: 372.39504

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1C(NC(=S)NC1=C)C2=CC=C(C=C2)OC(=O)C3=CC=CO3

Isomeric SMILES

COC(=O)C1C(NC(=S)NC1=C)C2=CC=C(C=C2)OC(=O)C3=CC=CO3

InChI

InChI=1S/C18H16N2O5S/c1-10-14(17(22)23-2)15(20-18(26)19-10)11-5-7-12(8-6-11)25-16(21)13-4-3-9-24-13/h3-9,14-15H,1H2,2H3,(H2,19,20,26)