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

Systemtic Name: ethyl 4-azanyl-2-[(3,5-diacetamidophenyl)carbonyloxymethyl]-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: ethyl 4-amino-2-[(3,5-diacetamidobenzoyl)oxymethyl]-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 4-amino-2-[[(3,5-diacetamidophenyl)-oxomethoxy]methyl]-5-methyl-6-thieno[2,3-d]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-amino-2-[(3,5-diacetamidobenzoyl)oxymethyl]-5-methylthieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 4-amino-2-[(3,5-diacetamidobenzoyl)oxymethyl]-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylic acid ethyl ester Formula: C22H23N5O6S MolecularWeight: 485.51292

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H23N5O6S/c1-5-32-22(31)18-10(2)17-19(23)26-16(27-20(17)34-18)9-33-21(30)13-6-14(24-11(3)28)8-15(7-13)25-12(4)29/h6-8H,5,9H2,1-4H3,(H,24,28)(H,25,29)(H2,23,26,27)