ethyl 4-azanyl-2-[[4-(cyclopropylcarbonylamino)phenyl]carbonyloxymethyl]-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: ethyl 4-azanyl-2-[[4-(cyclopropylcarbonylamino)phenyl]carbonyloxymethyl]-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: ethyl 4-amino-2-[[4-(cyclopropanecarbonylamino)benzoyl]oxymethyl]-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 4-amino-2-[[[4-[[cyclopropyl(oxo)methyl]amino]phenyl]-oxomethoxy]methyl]-5-methyl-6-thieno[2,3-d]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-amino-2-[[4-(cyclopropanecarbonylamino)benzoyl]oxymethyl]-5-methylthieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 4-amino-2-[[4-(cyclopropanecarbonylamino)benzoyl]oxymethyl]-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylic acid ethyl ester Formula: C22H22N4O5S MolecularWeight: 454.49888

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(N=C(N=C2S1)COC(=O)C3=CC=C(C=C3)NC(=O)C4CC4)N)C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(N=C(N=C2S1)COC(=O)C3=CC=C(C=C3)NC(=O)C4CC4)N)C

InChI

InChI=1S/C22H22N4O5S/c1-3-30-22(29)17-11(2)16-18(23)25-15(26-20(16)32-17)10-31-21(28)13-6-8-14(9-7-13)24-19(27)12-4-5-12/h6-9,12H,3-5,10H2,1-2H3,(H,24,27)(H2,23,25,26)