6-phenyl-2-pyridin-3-yl-4-(4-pyrimidin-2-ylpiperazin-1-yl)thieno[2,3-d]pyrimidine

Systemtic Name: 6-phenyl-2-pyridin-3-yl-4-(4-pyrimidin-2-ylpiperazin-1-yl)thieno[2,3-d]pyrimidine Openeye Name: 6-phenyl-2-(3-pyridyl)-4-(4-pyrimidin-2-ylpiperazin-1-yl)thieno[2,3-d]pyrimidine CAS Name: 6-phenyl-2-(3-pyridinyl)-4-[4-(2-pyrimidinyl)-1-piperazinyl]thieno[2,3-d]pyrimidine IUPAC Name: 6-phenyl-2-pyridin-3-yl-4-(4-pyrimidin-2-ylpiperazin-1-yl)thieno[2,3-d]pyrimidine Traditional Name: 6-phenyl-2-(3-pyridyl)-4-[4-(2-pyrimidyl)piperazino]thieno[2,3-d]pyrimidine Formula: C25H21N7S MolecularWeight: 451.54614

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C3C=C(SC3=NC(=N2)C4=CN=CC=C4)C5=CC=CC=C5)C6=NC=CC=N6

Isomeric SMILES

C1CN(CCN1C2=C3C=C(SC3=NC(=N2)C4=CN=CC=C4)C5=CC=CC=C5)C6=NC=CC=N6

InChI

InChI=1S/C25H21N7S/c1-2-6-18(7-3-1)21-16-20-23(29-22(30-24(20)33-21)19-8-4-9-26-17-19)31-12-14-32(15-13-31)25-27-10-5-11-28-25/h1-11,16-17H,12-15H2