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

Systemtic Name: ethyl 2-[[4,6-bis(oxidanylidene)-2-sulfanylidene-1,3-diazinan-5-ylidene]methylamino]-5-methyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[(4,6-dioxo-2-thioxo-hexahydropyrimidin-5-ylidene)methylamino]-5-methyl-thiophene-3-carboxylate CAS Name: 2-[(4,6-dioxo-2-sulfanylidene-1,3-diazinan-5-ylidene)methylamino]-5-methyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[(4,6-dioxo-2-sulfanylidene-1,3-diazinan-5-ylidene)methylamino]-5-methylthiophene-3-carboxylate Traditional Name: 2-[(4,6-diketo-2-thioxo-hexahydropyrimidin-5-ylidene)methylamino]-5-methyl-thiophene-3-carboxylic acid ethyl ester Formula: C13H13N3O4S2 MolecularWeight: 339.39002

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1)C)NC=C2C(=O)NC(=S)NC2=O

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1)C)NC=C2C(=O)NC(=S)NC2=O

InChI

InChI=1S/C13H13N3O4S2/c1-3-20-12(19)7-4-6(2)22-11(7)14-5-8-9(17)15-13(21)16-10(8)18/h4-5,14H,3H2,1-2H3,(H2,15,16,17,18,21)