(3E)-3-[cyclobutyl(nitroso)methylidene]-6-phenyl-6-pyrimidin-4-yl-2,7-dihydro-1H-indazole

Systemtic Name: (3E)-3-[cyclobutyl(nitroso)methylidene]-6-phenyl-6-pyrimidin-4-yl-2,7-dihydro-1H-indazole Openeye Name: (3E)-3-[cyclobutyl(nitroso)methylene]-6-phenyl-6-pyrimidin-4-yl-2,7-dihydro-1H-indazole CAS Name: (3E)-3-[cyclobutyl(nitroso)methylidene]-6-phenyl-6-(4-pyrimidinyl)-2,7-dihydro-1H-indazole IUPAC Name: (3E)-3-[cyclobutyl(nitroso)methylidene]-6-phenyl-6-pyrimidin-4-yl-2,7-dihydro-1H-indazole Traditional Name: (3E)-3-[cyclobutyl(nitroso)methylene]-6-phenyl-6-(4-pyrimidyl)-2,7-dihydro-1H-indazole Formula: C22H21N5O MolecularWeight: 371.43504

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C1)C(=C2C3=C(CC(C=C3)(C4=CC=CC=C4)C5=NC=NC=C5)NN2)N=O

Isomeric SMILES

C1CC(C1)/C(=C\2/C3=C(CC(C=C3)(C4=CC=CC=C4)C5=NC=NC=C5)NN2)/N=O

InChI

InChI=1S/C22H21N5O/c28-27-20(15-5-4-6-15)21-17-9-11-22(13-18(17)25-26-21,16-7-2-1-3-8-16)19-10-12-23-14-24-19/h1-3,7-12,14-15,25-26H,4-6,13H2/b21-20+