ethyl 2,5-dimethyl-4-[2-(4-phenylpiperazin-1-yl)ethylamino]thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: ethyl 2,5-dimethyl-4-[2-(4-phenylpiperazin-1-yl)ethylamino]thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: ethyl 2,5-dimethyl-4-[2-(4-phenylpiperazin-1-yl)ethylamino]thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 2,5-dimethyl-4-[2-(4-phenyl-1-piperazinyl)ethylamino]-6-thieno[2,3-d]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 2,5-dimethyl-4-[2-(4-phenylpiperazin-1-yl)ethylamino]thieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 2,5-dimethyl-4-[2-(4-phenylpiperazino)ethylamino]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:

CCOC(=O)C1=C(C2=C(N=C(N=C2S1)C)NCCN3CCN(CC3)C4=CC=CC=C4)C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(N=C(N=C2S1)C)NCCN3CCN(CC3)C4=CC=CC=C4)C

InChI

InChI=1S/C23H29N5O2S/c1-4-30-23(29)20-16(2)19-21(25-17(3)26-22(19)31-20)24-10-11-27-12-14-28(15-13-27)18-8-6-5-7-9-18/h5-9H,4,10-15H2,1-3H3,(H,24,25,26)