ethyl 2-[[3-(cyclopropylamino)-3-oxidanylidene-propyl]sulfanylmethyl]-5-methyl-4-oxidanylidene-3H-thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: ethyl 2-[[3-(cyclopropylamino)-3-oxidanylidene-propyl]sulfanylmethyl]-5-methyl-4-oxidanylidene-3H-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: ethyl 2-[[3-(cyclopropylamino)-3-oxo-propyl]sulfanylmethyl]-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 2-[[[3-(cyclopropylamino)-3-oxopropyl]thio]methyl]-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid ethyl ester IUPAC Name: ethyl 2-[[3-(cyclopropylamino)-3-oxopropyl]sulfanylmethyl]-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 2-[[[3-(cyclopropylamino)-3-keto-propyl]thio]methyl]-4-keto-5-methyl-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid ethyl ester Formula: C17H21N3O4S2 MolecularWeight: 395.49634

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(S1)N=C(NC2=O)CSCCC(=O)NC3CC3)C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(S1)N=C(NC2=O)CSCCC(=O)NC3CC3)C

InChI

InChI=1S/C17H21N3O4S2/c1-3-24-17(23)14-9(2)13-15(22)19-11(20-16(13)26-14)8-25-7-6-12(21)18-10-4-5-10/h10H,3-8H2,1-2H3,(H,18,21)(H,19,20,22)