5-phenyl-2-pyridin-3-yl-4-pyrimidin-2-ylsulfanyl-thieno[2,3-d]pyrimidine

Systemtic Name: 5-phenyl-2-pyridin-3-yl-4-pyrimidin-2-ylsulfanyl-thieno[2,3-d]pyrimidine Openeye Name: 5-phenyl-2-(3-pyridyl)-4-pyrimidin-2-ylsulfanyl-thieno[2,3-d]pyrimidine CAS Name: 5-phenyl-2-(3-pyridinyl)-4-(2-pyrimidinylthio)thieno[2,3-d]pyrimidine IUPAC Name: 5-phenyl-2-pyridin-3-yl-4-pyrimidin-2-ylsulfanylthieno[2,3-d]pyrimidine Traditional Name: 5-phenyl-2-(3-pyridyl)-4-(2-pyrimidylthio)thieno[2,3-d]pyrimidine Formula: C21H13N5S2 MolecularWeight: 399.49142

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CSC3=C2C(=NC(=N3)C4=CN=CC=C4)SC5=NC=CC=N5

Isomeric SMILES

C1=CC=C(C=C1)C2=CSC3=C2C(=NC(=N3)C4=CN=CC=C4)SC5=NC=CC=N5

InChI

InChI=1S/C21H13N5S2/c1-2-6-14(7-3-1)16-13-27-19-17(16)20(28-21-23-10-5-11-24-21)26-18(25-19)15-8-4-9-22-12-15/h1-13H