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

Systemtic Name: ethyl 5-methyl-4-[(4-propan-2-yloxyphenyl)amino]thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: ethyl 4-(4-isopropoxyanilino)-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 5-methyl-4-(4-propan-2-yloxyanilino)-6-thieno[2,3-d]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 5-methyl-4-(4-propan-2-yloxyanilino)thieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 4-(4-isopropoxyanilino)-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylic acid ethyl ester Formula: C19H21N3O3S MolecularWeight: 371.45334

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H21N3O3S/c1-5-24-19(23)16-12(4)15-17(20-10-21-18(15)26-16)22-13-6-8-14(9-7-13)25-11(2)3/h6-11H,5H2,1-4H3,(H,20,21,22)