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

Systemtic Name: ethyl 5-methyl-4-oxidanylidene-2-[(N'-propan-2-ylcarbamimidoyl)sulfanylmethyl]-3H-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: ethyl 2-[(N'-isopropylcarbamimidoyl)sulfanylmethyl]-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 2-[[[amino(propan-2-ylimino)methyl]thio]methyl]-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid ethyl ester IUPAC Name: ethyl 5-methyl-4-oxo-2-[(N'-propan-2-ylcarbamimidoyl)sulfanylmethyl]-3H-thieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 2-[[(N'-isopropylamidino)thio]methyl]-4-keto-5-methyl-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid ethyl ester Formula: C15H20N4O3S2 MolecularWeight: 368.4743

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(S1)N=C(NC2=O)CSC(=NC(C)C)N)C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(S1)N=C(NC2=O)CSC(=NC(C)C)N)C

InChI

InChI=1S/C15H20N4O3S2/c1-5-22-14(21)11-8(4)10-12(20)18-9(19-13(10)24-11)6-23-15(16)17-7(2)3/h7H,5-6H2,1-4H3,(H2,16,17)(H,18,19,20)