6-cyclohexyl-7-oxidanylidene-5-(4-phenylmethoxyphenyl)-1H-pyrazolo[1,5-a]pyrimidine-2-carbonitrile

Systemtic Name: 6-cyclohexyl-7-oxidanylidene-5-(4-phenylmethoxyphenyl)-1H-pyrazolo[1,5-a]pyrimidine-2-carbonitrile Openeye Name: 5-(4-benzyloxyphenyl)-6-cyclohexyl-7-oxo-1H-pyrazolo[1,5-a]pyrimidine-2-carbonitrile CAS Name: 6-cyclohexyl-7-oxo-5-(4-phenylmethoxyphenyl)-1H-pyrazolo[1,5-a]pyrimidine-2-carbonitrile IUPAC Name: 6-cyclohexyl-7-oxo-5-(4-phenylmethoxyphenyl)-1H-pyrazolo[1,5-a]pyrimidine-2-carbonitrile Traditional Name: 5-(4-benzoxyphenyl)-6-cyclohexyl-7-keto-1H-pyrazolo[1,5-a]pyrimidine-2-carbonitrile Formula: C26H24N4O2 MolecularWeight: 424.49436

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=C(N=C3C=C(NN3C2=O)C#N)C4=CC=C(C=C4)OCC5=CC=CC=C5

Isomeric SMILES

C1CCC(CC1)C2=C(N=C3C=C(NN3C2=O)C#N)C4=CC=C(C=C4)OCC5=CC=CC=C5

InChI

InChI=1S/C26H24N4O2/c27-16-21-15-23-28-25(24(26(31)30(23)29-21)19-9-5-2-6-10-19)20-11-13-22(14-12-20)32-17-18-7-3-1-4-8-18/h1,3-4,7-8,11-15,19,29H,2,5-6,9-10,17H2