ethyl 4-azanyl-5-methyl-2-[3-(thiophen-3-ylcarbonylamino)propanoyloxymethyl]thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: ethyl 4-azanyl-5-methyl-2-[3-(thiophen-3-ylcarbonylamino)propanoyloxymethyl]thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: ethyl 4-amino-5-methyl-2-[3-(thiophene-3-carbonylamino)propanoyloxymethyl]thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 4-amino-5-methyl-2-[[1-oxo-3-[[oxo(3-thiophenyl)methyl]amino]propoxy]methyl]-6-thieno[2,3-d]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-amino-5-methyl-2-[3-(thiophene-3-carbonylamino)propanoyloxymethyl]thieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 4-amino-5-methyl-2-[3-(3-thenoylamino)propanoyloxymethyl]thieno[2,3-d]pyrimidine-6-carboxylic acid ethyl ester Formula: C19H20N4O5S2 MolecularWeight: 448.5159

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(N=C(N=C2S1)COC(=O)CCNC(=O)C3=CSC=C3)N)C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(N=C(N=C2S1)COC(=O)CCNC(=O)C3=CSC=C3)N)C

InChI

InChI=1S/C19H20N4O5S2/c1-3-27-19(26)15-10(2)14-16(20)22-12(23-18(14)30-15)8-28-13(24)4-6-21-17(25)11-5-7-29-9-11/h5,7,9H,3-4,6,8H2,1-2H3,(H,21,25)(H2,20,22,23)