5-(3-phenyl-1-pyrimidin-2-yl-azirin-2-yl)-7-pyrimidin-2-yl-7-azabicyclo[4.1.0]hepta-1,3,5-triene

Systemtic Name: 5-(3-phenyl-1-pyrimidin-2-yl-azirin-2-yl)-7-pyrimidin-2-yl-7-azabicyclo[4.1.0]hepta-1,3,5-triene Openeye Name: 5-(3-phenyl-1-pyrimidin-2-yl-azirin-2-yl)-7-pyrimidin-2-yl-7-azabicyclo[4.1.0]hepta-1,3,5-triene CAS Name: 5-[3-phenyl-1-(2-pyrimidinyl)-2-azirinyl]-7-(2-pyrimidinyl)-7-azabicyclo[4.1.0]hepta-1,3,5-triene IUPAC Name: 5-(3-phenyl-1-pyrimidin-2-ylazirin-2-yl)-7-pyrimidin-2-yl-7-azabicyclo[4.1.0]hepta-1,3,5-triene Traditional Name: 5-[3-phenyl-1-(2-pyrimidyl)azirin-2-yl]-7-(2-pyrimidyl)-7-azabicyclo[4.1.0]hepta-1,3,5-triene Formula: C22H14N6 MolecularWeight: 362.38676

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(N2C3=NC=CC=N3)C4=C5C(=CC=C4)N5C6=NC=CC=N6

Isomeric SMILES

C1=CC=C(C=C1)C2=C(N2C3=NC=CC=N3)C4=C5C(=CC=C4)N5C6=NC=CC=N6

InChI

InChI=1S/C22H14N6/c1-2-7-15(8-3-1)18-20(28(18)22-25-13-6-14-26-22)16-9-4-10-17-19(16)27(17)21-23-11-5-12-24-21/h1-14H