4-(1-oxidanidylpyridin-1-ium-2-yl)oxy-5-phenyl-2-pyridin-2-yl-thieno[2,3-d]pyrimidine

Systemtic Name: 4-(1-oxidanidylpyridin-1-ium-2-yl)oxy-5-phenyl-2-pyridin-2-yl-thieno[2,3-d]pyrimidine Openeye Name: 4-(1-oxidopyridin-1-ium-2-yl)oxy-5-phenyl-2-(2-pyridyl)thieno[2,3-d]pyrimidine CAS Name: 4-[(1-oxido-2-pyridin-1-iumyl)oxy]-5-phenyl-2-(2-pyridinyl)thieno[2,3-d]pyrimidine IUPAC Name: 4-(1-oxidopyridin-1-ium-2-yl)oxy-5-phenyl-2-pyridin-2-ylthieno[2,3-d]pyrimidine Traditional Name: 4-(1-oxidopyridin-1-ium-2-yl)oxy-5-phenyl-2-(2-pyridyl)thieno[2,3-d]pyrimidine Formula: C22H14N4O2S MolecularWeight: 398.43716

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CSC3=NC(=NC(=C23)OC4=CC=CC=[N+]4[O-])C5=CC=CC=N5

Isomeric SMILES

C1=CC=C(C=C1)C2=CSC3=NC(=NC(=C23)OC4=CC=CC=[N+]4[O-])C5=CC=CC=N5

InChI

InChI=1S/C22H14N4O2S/c27-26-13-7-5-11-18(26)28-21-19-16(15-8-2-1-3-9-15)14-29-22(19)25-20(24-21)17-10-4-6-12-23-17/h1-14H