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

Systemtic Name: ethyl 5-methyl-4-[(3-propan-2-yloxycarbonylphenyl)amino]thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: ethyl 4-(3-isopropoxycarbonylanilino)-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 5-methyl-4-[3-[oxo(propan-2-yloxy)methyl]anilino]-6-thieno[2,3-d]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 5-methyl-4-(3-propan-2-yloxycarbonylanilino)thieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 4-(3-isopropoxycarbonylanilino)-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylic acid ethyl ester Formula: C20H21N3O4S MolecularWeight: 399.46344

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H21N3O4S/c1-5-26-20(25)16-12(4)15-17(21-10-22-18(15)28-16)23-14-8-6-7-13(9-14)19(24)27-11(2)3/h6-11H,5H2,1-4H3,(H,21,22,23)