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

Systemtic Name: 3-(1-adamantyl)-1-(4-bromophenyl)-4,5-dihydro-2H-pyrrolo[2,3-c]pyrazole Openeye Name: 3-(1-adamantyl)-1-(4-bromophenyl)-4,5-dihydro-2H-pyrrolo[2,3-c]pyrazole CAS Name: 3-(1-adamantyl)-1-(4-bromophenyl)-4,5-dihydro-2H-pyrrolo[2,3-c]pyrazole IUPAC Name: 3-(1-adamantyl)-1-(4-bromophenyl)-4,5-dihydro-2H-pyrrolo[2,3-c]pyrazole Traditional Name: 3-(1-adamantyl)-1-(4-bromophenyl)-4,5-dihydro-2H-pyrrolo[2,3-c]pyrazole Formula: C21H24BrN3 MolecularWeight: 398.33936

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H24BrN3/c22-16-1-3-17(4-2-16)25-20-18(5-6-23-20)19(24-25)21-10-13-7-14(11-21)9-15(8-13)12-21/h1-4,13-15,24H,5-12H2