ethyl 4-azanyl-2-[2-(3-methoxycarbonylindol-1-yl)ethanoyloxymethyl]-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: ethyl 4-azanyl-2-[2-(3-methoxycarbonylindol-1-yl)ethanoyloxymethyl]-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: ethyl 4-amino-2-[[2-(3-methoxycarbonylindol-1-yl)acetyl]oxymethyl]-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 4-amino-2-[[2-(3-methoxycarbonyl-1-indolyl)-1-oxoethoxy]methyl]-5-methyl-6-thieno[2,3-d]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-amino-2-[[2-(3-methoxycarbonylindol-1-yl)acetyl]oxymethyl]-5-methylthieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 4-amino-2-[[2-(3-carbomethoxyindol-1-yl)acetyl]oxymethyl]-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylic acid ethyl ester Formula: C23H22N4O6S MolecularWeight: 482.50898

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(N=C(N=C2S1)COC(=O)CN3C=C(C4=CC=CC=C43)C(=O)OC)N)C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(N=C(N=C2S1)COC(=O)CN3C=C(C4=CC=CC=C43)C(=O)OC)N)C

InChI

InChI=1S/C23H22N4O6S/c1-4-32-23(30)19-12(2)18-20(24)25-16(26-21(18)34-19)11-33-17(28)10-27-9-14(22(29)31-3)13-7-5-6-8-15(13)27/h5-9H,4,10-11H2,1-3H3,(H2,24,25,26)