3-(1-adamantyl)-1-(3-methylphenyl)-4,5-dihydro-2H-pyrrolo[2,3-c]pyrazole

Systemtic Name: 3-(1-adamantyl)-1-(3-methylphenyl)-4,5-dihydro-2H-pyrrolo[2,3-c]pyrazole Openeye Name: 3-(1-adamantyl)-1-(m-tolyl)-4,5-dihydro-2H-pyrrolo[2,3-c]pyrazole CAS Name: 3-(1-adamantyl)-1-(3-methylphenyl)-4,5-dihydro-2H-pyrrolo[2,3-c]pyrazole IUPAC Name: 3-(1-adamantyl)-1-(3-methylphenyl)-4,5-dihydro-2H-pyrrolo[2,3-c]pyrazole Traditional Name: 3-(1-adamantyl)-1-(m-tolyl)-4,5-dihydro-2H-pyrrolo[2,3-c]pyrazole Formula: C22H27N3 MolecularWeight: 333.46988

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C3=NCCC3=C(N2)C45CC6CC(C4)CC(C6)C5

Isomeric SMILES

CC1=CC(=CC=C1)N2C3=NCCC3=C(N2)C45CC6CC(C4)CC(C6)C5

InChI

InChI=1S/C22H27N3/c1-14-3-2-4-18(7-14)25-21-19(5-6-23-21)20(24-25)22-11-15-8-16(12-22)10-17(9-15)13-22/h2-4,7,15-17,24H,5-6,8-13H2,1H3