methyl 5-cyano-4-[5-(5-cyano-4-methoxycarbonyl-6-oxidanylidene-2-sulfanylidene-1,3-diazinan-4-yl)-2,4-bis(oxidanylidene)pentyl]-6-oxidanylidene-2-sulfanylidene-1,3-diazinane-4-carboxylate

Systemtic Name: methyl 5-cyano-4-[5-(5-cyano-4-methoxycarbonyl-6-oxidanylidene-2-sulfanylidene-1,3-diazinan-4-yl)-2,4-bis(oxidanylidene)pentyl]-6-oxidanylidene-2-sulfanylidene-1,3-diazinane-4-carboxylate Openeye Name: methyl 5-cyano-4-[5-(5-cyano-4-methoxycarbonyl-6-oxo-2-thioxo-hexahydropyrimidin-4-yl)-2,4-dioxo-pentyl]-6-oxo-2-thioxo-hexahydropyrimidine-4-carboxylate CAS Name: 5-cyano-4-[5-(5-cyano-4-methoxycarbonyl-6-oxo-2-sulfanylidene-1,3-diazinan-4-yl)-2,4-dioxopentyl]-6-oxo-2-sulfanylidene-1,3-diazinane-4-carboxylic acid methyl ester IUPAC Name: methyl 5-cyano-4-[5-(5-cyano-4-methoxycarbonyl-6-oxo-2-sulfanylidene-1,3-diazinan-4-yl)-2,4-dioxopentyl]-6-oxo-2-sulfanylidene-1,3-diazinane-4-carboxylate Traditional Name: 4-[5-(4-carbomethoxy-5-cyano-6-keto-2-thioxo-hexahydropyrimidin-4-yl)-2,4-diketo-pentyl]-5-cyano-6-keto-2-thioxo-hexahydropyrimidine-4-carboxylic acid methyl ester Formula: C19H18N6O8S2 MolecularWeight: 522.51162

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1(C(C(=O)NC(=S)N1)C#N)CC(=O)CC(=O)CC2(C(C(=O)NC(=S)N2)C#N)C(=O)OC

Isomeric SMILES

COC(=O)C1(C(C(=O)NC(=S)N1)C#N)CC(=O)CC(=O)CC2(C(C(=O)NC(=S)N2)C#N)C(=O)OC

InChI

InChI=1S/C19H18N6O8S2/c1-32-14(30)18(10(6-20)12(28)22-16(34)24-18)4-8(26)3-9(27)5-19(15(31)33-2)11(7-21)13(29)23-17(35)25-19/h10-11H,3-5H2,1-2H3,(H2,22,24,28,34)(H2,23,25,29,35)