5-[6,6-di(pyrimidin-4-yl)-1,7-dihydroindazol-3-yl]-3-methyl-1,2,4-oxadiazole

Systemtic Name: 5-[6,6-di(pyrimidin-4-yl)-1,7-dihydroindazol-3-yl]-3-methyl-1,2,4-oxadiazole Openeye Name: 5-[6,6-di(pyrimidin-4-yl)-1,7-dihydroindazol-3-yl]-3-methyl-1,2,4-oxadiazole CAS Name: 5-[6,6-bis(4-pyrimidinyl)-1,7-dihydroindazol-3-yl]-3-methyl-1,2,4-oxadiazole IUPAC Name: 5-[6,6-di(pyrimidin-4-yl)-1,7-dihydroindazol-3-yl]-3-methyl-1,2,4-oxadiazole Traditional Name: 5-[6,6-bis(4-pyrimidyl)-1,7-dihydroindazol-3-yl]-3-methyl-1,2,4-oxadiazole Formula: C18H14N8O MolecularWeight: 358.35676

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(=N1)C2=NNC3=C2C=CC(C3)(C4=NC=NC=C4)C5=NC=NC=C5

Isomeric SMILES

CC1=NOC(=N1)C2=NNC3=C2C=CC(C3)(C4=NC=NC=C4)C5=NC=NC=C5

InChI

InChI=1S/C18H14N8O/c1-11-23-17(27-26-11)16-12-2-5-18(8-13(12)24-25-16,14-3-6-19-9-21-14)15-4-7-20-10-22-15/h2-7,9-10H,8H2,1H3,(H,24,25)