3-methyl-1-phenyl-5-[4-(phenylmethyl)piperazin-1-yl]pyrazole-4-carbaldehyde

Systemtic Name: 3-methyl-1-phenyl-5-[4-(phenylmethyl)piperazin-1-yl]pyrazole-4-carbaldehyde Openeye Name: 5-(4-benzylpiperazin-1-yl)-3-methyl-1-phenyl-pyrazole-4-carbaldehyde CAS Name: 3-methyl-1-phenyl-5-[4-(phenylmethyl)-1-piperazinyl]-4-pyrazolecarboxaldehyde IUPAC Name: 5-(4-benzylpiperazin-1-yl)-3-methyl-1-phenylpyrazole-4-carbaldehyde Traditional Name: 5-(4-benzylpiperazino)-3-methyl-1-phenyl-pyrazole-4-carbaldehyde Formula: C22H24N4O MolecularWeight: 360.45216

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C=O)N2CCN(CC2)CC3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC1=NN(C(=C1C=O)N2CCN(CC2)CC3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C22H24N4O/c1-18-21(17-27)22(26(23-18)20-10-6-3-7-11-20)25-14-12-24(13-15-25)16-19-8-4-2-5-9-19/h2-11,17H,12-16H2,1H3