2-phenyl-N5-[[2-[(4-phenylpiperazin-1-yl)methyl]phenyl]methyl]-3,4-dihydropyrazole-3,5-dicarboxamide

Systemtic Name: 2-phenyl-N5-[[2-[(4-phenylpiperazin-1-yl)methyl]phenyl]methyl]-3,4-dihydropyrazole-3,5-dicarboxamide Openeye Name: 2-phenyl-N5-[[2-[(4-phenylpiperazin-1-yl)methyl]phenyl]methyl]-3,4-dihydropyrazole-3,5-dicarboxamide CAS Name: 2-phenyl-N5-[[2-[(4-phenyl-1-piperazinyl)methyl]phenyl]methyl]-3,4-dihydropyrazole-3,5-dicarboxamide IUPAC Name: 2-phenyl-5-N-[[2-[(4-phenylpiperazin-1-yl)methyl]phenyl]methyl]-3,4-dihydropyrazole-3,5-dicarboxamide Traditional Name: 1-phenyl-N-[2-[(4-phenylpiperazino)methyl]benzyl]-2-pyrazoline-3,5-dicarboxamide Formula: C29H32N6O2 MolecularWeight: 496.60338

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2CNC(=O)C3=NN(C(C3)C(=O)N)C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2CNC(=O)C3=NN(C(C3)C(=O)N)C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C29H32N6O2/c30-28(36)27-19-26(32-35(27)25-13-5-2-6-14-25)29(37)31-20-22-9-7-8-10-23(22)21-33-15-17-34(18-16-33)24-11-3-1-4-12-24/h1-14,27H,15-21H2,(H2,30,36)(H,31,37)