methyl 2-[(N'-ethylcarbamimidoyl)sulfanylmethyl]-5-methyl-4-oxidanylidene-3H-thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: methyl 2-[(N'-ethylcarbamimidoyl)sulfanylmethyl]-5-methyl-4-oxidanylidene-3H-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: methyl 2-[(N'-ethylcarbamimidoyl)sulfanylmethyl]-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 2-[[[amino(ethylimino)methyl]thio]methyl]-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid methyl ester IUPAC Name: methyl 2-[(N'-ethylcarbamimidoyl)sulfanylmethyl]-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 2-[[(N'-ethylamidino)thio]methyl]-4-keto-5-methyl-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid methyl ester Formula: C13H16N4O3S2 MolecularWeight: 340.42114

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Descriptors Computed from Structure

Canonical SMILES:

CCN=C(N)SCC1=NC2=C(C(=C(S2)C(=O)OC)C)C(=O)N1

Isomeric SMILES

CCN=C(N)SCC1=NC2=C(C(=C(S2)C(=O)OC)C)C(=O)N1

InChI

InChI=1S/C13H16N4O3S2/c1-4-15-13(14)21-5-7-16-10(18)8-6(2)9(12(19)20-3)22-11(8)17-7/h4-5H2,1-3H3,(H2,14,15)(H,16,17,18)