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

Systemtic Name: ethyl 5-methyl-4-[[4-(2-methylpropanoylamino)phenyl]amino]thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: ethyl 5-methyl-4-[4-(2-methylpropanoylamino)anilino]thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 5-methyl-4-[4-[(2-methyl-1-oxopropyl)amino]anilino]-6-thieno[2,3-d]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 5-methyl-4-[4-(2-methylpropanoylamino)anilino]thieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 4-[4-(isobutyrylamino)anilino]-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylic acid ethyl ester Formula: C20H22N4O3S MolecularWeight: 398.47868

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(N=CN=C2S1)NC3=CC=C(C=C3)NC(=O)C(C)C)C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(N=CN=C2S1)NC3=CC=C(C=C3)NC(=O)C(C)C)C

InChI

InChI=1S/C20H22N4O3S/c1-5-27-20(26)16-12(4)15-17(21-10-22-19(15)28-16)23-13-6-8-14(9-7-13)24-18(25)11(2)3/h6-11H,5H2,1-4H3,(H,24,25)(H,21,22,23)