4-[3-(1-adamantyl)-4,5-dihydro-2H-pyrrolo[2,3-c]pyrazol-1-yl]benzenecarbonitrile

Systemtic Name: 4-[3-(1-adamantyl)-4,5-dihydro-2H-pyrrolo[2,3-c]pyrazol-1-yl]benzenecarbonitrile Openeye Name: 4-[3-(1-adamantyl)-4,5-dihydro-2H-pyrrolo[2,3-c]pyrazol-1-yl]benzonitrile CAS Name: 4-[3-(1-adamantyl)-4,5-dihydro-2H-pyrrolo[2,3-c]pyrazol-1-yl]benzonitrile IUPAC Name: 4-[3-(1-adamantyl)-4,5-dihydro-2H-pyrrolo[2,3-c]pyrazol-1-yl]benzonitrile Traditional Name: 4-[3-(1-adamantyl)-4,5-dihydro-2H-pyrrolo[2,3-c]pyrazol-1-yl]benzonitrile Formula: C22H24N4 MolecularWeight: 344.45276

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Descriptors Computed from Structure

Canonical SMILES:

C1CN=C2C1=C(NN2C3=CC=C(C=C3)C#N)C45CC6CC(C4)CC(C6)C5

Isomeric SMILES

C1CN=C2C1=C(NN2C3=CC=C(C=C3)C#N)C45CC6CC(C4)CC(C6)C5

InChI

InChI=1S/C22H24N4/c23-13-14-1-3-18(4-2-14)26-21-19(5-6-24-21)20(25-26)22-10-15-7-16(11-22)9-17(8-15)12-22/h1-4,15-17,25H,5-12H2