3,5-dimethyl-1-phenyl-N-[4-[4-(phenylmethyl)piperazin-1-yl]phenyl]pyrazole-4-carboxamide

Systemtic Name: 3,5-dimethyl-1-phenyl-N-[4-[4-(phenylmethyl)piperazin-1-yl]phenyl]pyrazole-4-carboxamide Openeye Name: N-[4-(4-benzylpiperazin-1-yl)phenyl]-3,5-dimethyl-1-phenyl-pyrazole-4-carboxamide CAS Name: 3,5-dimethyl-1-phenyl-N-[4-[4-(phenylmethyl)-1-piperazinyl]phenyl]-4-pyrazolecarboxamide IUPAC Name: N-[4-(4-benzylpiperazin-1-yl)phenyl]-3,5-dimethyl-1-phenylpyrazole-4-carboxamide Traditional Name: N-[4-(4-benzylpiperazino)phenyl]-3,5-dimethyl-1-phenyl-pyrazole-4-carboxamide Formula: C29H31N5O MolecularWeight: 465.58934

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)C(=O)NC3=CC=C(C=C3)N4CCN(CC4)CC5=CC=CC=C5

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)C(=O)NC3=CC=C(C=C3)N4CCN(CC4)CC5=CC=CC=C5

InChI

InChI=1S/C29H31N5O/c1-22-28(23(2)34(31-22)27-11-7-4-8-12-27)29(35)30-25-13-15-26(16-14-25)33-19-17-32(18-20-33)21-24-9-5-3-6-10-24/h3-16H,17-21H2,1-2H3,(H,30,35)