methyl 3-[[2,4,6-tris(oxidanylidene)-1,3-diazinan-5-ylidene]methylamino]thiophene-2-carboxylate

Systemtic Name: methyl 3-[[2,4,6-tris(oxidanylidene)-1,3-diazinan-5-ylidene]methylamino]thiophene-2-carboxylate Openeye Name: methyl 3-[(2,4,6-trioxohexahydropyrimidin-5-ylidene)methylamino]thiophene-2-carboxylate CAS Name: 3-[(2,4,6-trioxo-1,3-diazinan-5-ylidene)methylamino]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 3-[(2,4,6-trioxo-1,3-diazinan-5-ylidene)methylamino]thiophene-2-carboxylate Traditional Name: 3-[(2,4,6-triketohexahydropyrimidin-5-ylidene)methylamino]thiophene-2-carboxylic acid methyl ester Formula: C11H9N3O5S MolecularWeight: 295.27126

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CS1)NC=C2C(=O)NC(=O)NC2=O

Isomeric SMILES

COC(=O)C1=C(C=CS1)NC=C2C(=O)NC(=O)NC2=O

InChI

InChI=1S/C11H9N3O5S/c1-19-10(17)7-6(2-3-20-7)12-4-5-8(15)13-11(18)14-9(5)16/h2-4,12H,1H3,(H2,13,14,15,16,18)