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

Systemtic Name: ethyl 4-azanyl-5-methyl-2-[(1-methylindol-3-yl)carbonyloxymethyl]thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: ethyl 4-amino-5-methyl-2-[(1-methylindole-3-carbonyl)oxymethyl]thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 4-amino-5-methyl-2-[[(1-methyl-3-indolyl)-oxomethoxy]methyl]-6-thieno[2,3-d]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-amino-5-methyl-2-[(1-methylindole-3-carbonyl)oxymethyl]thieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 4-amino-5-methyl-2-[(1-methylindole-3-carbonyl)oxymethyl]thieno[2,3-d]pyrimidine-6-carboxylic acid ethyl ester Formula: C21H20N4O4S MolecularWeight: 424.4729

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(N=C(N=C2S1)COC(=O)C3=CN(C4=CC=CC=C43)C)N)C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(N=C(N=C2S1)COC(=O)C3=CN(C4=CC=CC=C43)C)N)C

InChI

InChI=1S/C21H20N4O4S/c1-4-28-21(27)17-11(2)16-18(22)23-15(24-19(16)30-17)10-29-20(26)13-9-25(3)14-8-6-5-7-12(13)14/h5-9H,4,10H2,1-3H3,(H2,22,23,24)