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

Systemtic Name: ethyl 4-azanyl-5-methyl-2-[3-(2-phenylethanoylamino)propanoyloxymethyl]thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: ethyl 4-amino-5-methyl-2-[3-[(2-phenylacetyl)amino]propanoyloxymethyl]thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 4-amino-5-methyl-2-[[1-oxo-3-[(1-oxo-2-phenylethyl)amino]propoxy]methyl]-6-thieno[2,3-d]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-amino-5-methyl-2-[3-[(2-phenylacetyl)amino]propanoyloxymethyl]thieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 4-amino-5-methyl-2-[3-[(2-phenylacetyl)amino]propanoyloxymethyl]thieno[2,3-d]pyrimidine-6-carboxylic acid ethyl ester Formula: C22H24N4O5S MolecularWeight: 456.51476

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(N=C(N=C2S1)COC(=O)CCNC(=O)CC3=CC=CC=C3)N)C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(N=C(N=C2S1)COC(=O)CCNC(=O)CC3=CC=CC=C3)N)C

InChI

InChI=1S/C22H24N4O5S/c1-3-30-22(29)19-13(2)18-20(23)25-15(26-21(18)32-19)12-31-17(28)9-10-24-16(27)11-14-7-5-4-6-8-14/h4-8H,3,9-12H2,1-2H3,(H,24,27)(H2,23,25,26)