ethyl 4-[[4-(diethylamino)-2-methyl-phenyl]amino]-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: ethyl 4-[[4-(diethylamino)-2-methyl-phenyl]amino]-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: ethyl 4-[4-(diethylamino)-2-methyl-anilino]-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 4-[4-(diethylamino)-2-methylanilino]-5-methyl-6-thieno[2,3-d]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[4-(diethylamino)-2-methylanilino]-5-methylthieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 4-[4-(diethylamino)-2-methyl-anilino]-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylic acid ethyl ester Formula: C21H26N4O2S MolecularWeight: 398.52174

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC(=C(C=C1)NC2=C3C(=C(SC3=NC=N2)C(=O)OCC)C)C

Isomeric SMILES

CCN(CC)C1=CC(=C(C=C1)NC2=C3C(=C(SC3=NC=N2)C(=O)OCC)C)C

InChI

InChI=1S/C21H26N4O2S/c1-6-25(7-2)15-9-10-16(13(4)11-15)24-19-17-14(5)18(21(26)27-8-3)28-20(17)23-12-22-19/h9-12H,6-8H2,1-5H3,(H,22,23,24)