1-[5-(4-bromanyl-3-methyl-phenyl)-4-pyridin-4-yl-1H-pyrazol-3-yl]-4-methyl-piperazine

Systemtic Name: 1-[5-(4-bromanyl-3-methyl-phenyl)-4-pyridin-4-yl-1H-pyrazol-3-yl]-4-methyl-piperazine Openeye Name: 1-[5-(4-bromo-3-methyl-phenyl)-4-(4-pyridyl)-1H-pyrazol-3-yl]-4-methyl-piperazine CAS Name: 1-[5-(4-bromo-3-methylphenyl)-4-pyridin-4-yl-1H-pyrazol-3-yl]-4-methylpiperazine IUPAC Name: 1-[5-(4-bromo-3-methylphenyl)-4-pyridin-4-yl-1H-pyrazol-3-yl]-4-methylpiperazine Traditional Name: 1-[5-(4-bromo-3-methyl-phenyl)-4-(4-pyridyl)-1H-pyrazol-3-yl]-4-methyl-piperazine Formula: C20H22BrN5 MolecularWeight: 412.32618

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C2=C(C(=NN2)N3CCN(CC3)C)C4=CC=NC=C4)Br

Isomeric SMILES

CC1=C(C=CC(=C1)C2=C(C(=NN2)N3CCN(CC3)C)C4=CC=NC=C4)Br

InChI

InChI=1S/C20H22BrN5/c1-14-13-16(3-4-17(14)21)19-18(15-5-7-22-8-6-15)20(24-23-19)26-11-9-25(2)10-12-26/h3-8,13H,9-12H2,1-2H3,(H,23,24)