6-ethyl-4-[4-[(2-phenylquinolin-4-yl)methyl]piperazin-1-yl]thieno[2,3-d]pyrimidine

Systemtic Name: 6-ethyl-4-[4-[(2-phenylquinolin-4-yl)methyl]piperazin-1-yl]thieno[2,3-d]pyrimidine Openeye Name: 6-ethyl-4-[4-[(2-phenyl-4-quinolyl)methyl]piperazin-1-yl]thieno[2,3-d]pyrimidine CAS Name: 6-ethyl-4-[4-[(2-phenyl-4-quinolinyl)methyl]-1-piperazinyl]thieno[2,3-d]pyrimidine IUPAC Name: 6-ethyl-4-[4-[(2-phenylquinolin-4-yl)methyl]piperazin-1-yl]thieno[2,3-d]pyrimidine Traditional Name: 6-ethyl-4-[4-[(2-phenyl-4-quinolyl)methyl]piperazino]thieno[2,3-d]pyrimidine Formula: C28H27N5S MolecularWeight: 465.61248

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(N=CN=C2S1)N3CCN(CC3)CC4=CC(=NC5=CC=CC=C54)C6=CC=CC=C6

Isomeric SMILES

CCC1=CC2=C(N=CN=C2S1)N3CCN(CC3)CC4=CC(=NC5=CC=CC=C54)C6=CC=CC=C6

InChI

InChI=1S/C28H27N5S/c1-2-22-17-24-27(29-19-30-28(24)34-22)33-14-12-32(13-15-33)18-21-16-26(20-8-4-3-5-9-20)31-25-11-7-6-10-23(21)25/h3-11,16-17,19H,2,12-15,18H2,1H3