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

Systemtic Name: ethyl 2-[[3-(cyclopentylamino)-3-oxidanylidene-propyl]sulfanylmethyl]-5-methyl-4-oxidanylidene-3H-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: ethyl 2-[[3-(cyclopentylamino)-3-oxo-propyl]sulfanylmethyl]-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 2-[[[3-(cyclopentylamino)-3-oxopropyl]thio]methyl]-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid ethyl ester IUPAC Name: ethyl 2-[[3-(cyclopentylamino)-3-oxopropyl]sulfanylmethyl]-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 2-[[[3-(cyclopentylamino)-3-keto-propyl]thio]methyl]-4-keto-5-methyl-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid ethyl ester Formula: C19H25N3O4S2 MolecularWeight: 423.5495

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(S1)N=C(NC2=O)CSCCC(=O)NC3CCCC3)C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(S1)N=C(NC2=O)CSCCC(=O)NC3CCCC3)C

InChI

InChI=1S/C19H25N3O4S2/c1-3-26-19(25)16-11(2)15-17(24)21-13(22-18(15)28-16)10-27-9-8-14(23)20-12-6-4-5-7-12/h12H,3-10H2,1-2H3,(H,20,23)(H,21,22,24)