ethyl 4-[[4-(4-ethylpiperazin-1-yl)-2-methyl-phenyl]amino]-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: ethyl 4-[[4-(4-ethylpiperazin-1-yl)-2-methyl-phenyl]amino]-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: ethyl 4-[4-(4-ethylpiperazin-1-yl)-2-methyl-anilino]-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 4-[4-(4-ethyl-1-piperazinyl)-2-methylanilino]-5-methyl-6-thieno[2,3-d]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[4-(4-ethylpiperazin-1-yl)-2-methylanilino]-5-methylthieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 4-[4-(4-ethylpiperazino)-2-methyl-anilino]-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylic acid ethyl ester Formula: C23H29N5O2S MolecularWeight: 439.57366

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=CC(=C(C=C2)NC3=C4C(=C(SC4=NC=N3)C(=O)OCC)C)C

Isomeric SMILES

CCN1CCN(CC1)C2=CC(=C(C=C2)NC3=C4C(=C(SC4=NC=N3)C(=O)OCC)C)C

InChI

InChI=1S/C23H29N5O2S/c1-5-27-9-11-28(12-10-27)17-7-8-18(15(3)13-17)26-21-19-16(4)20(23(29)30-6-2)31-22(19)25-14-24-21/h7-8,13-14H,5-6,9-12H2,1-4H3,(H,24,25,26)