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

Systemtic Name: 5-chloranyl-3-methyl-1-phenyl-N-[4-[4-(phenylmethyl)piperazin-1-yl]phenyl]pyrazole-4-carboxamide Openeye Name: N-[4-(4-benzylpiperazin-1-yl)phenyl]-5-chloro-3-methyl-1-phenyl-pyrazole-4-carboxamide CAS Name: 5-chloro-3-methyl-1-phenyl-N-[4-[4-(phenylmethyl)-1-piperazinyl]phenyl]-4-pyrazolecarboxamide IUPAC Name: N-[4-(4-benzylpiperazin-1-yl)phenyl]-5-chloro-3-methyl-1-phenylpyrazole-4-carboxamide Traditional Name: N-[4-(4-benzylpiperazino)phenyl]-5-chloro-3-methyl-1-phenyl-pyrazole-4-carboxamide Formula: C28H28ClN5O MolecularWeight: 486.00782

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(=O)NC2=CC=C(C=C2)N3CCN(CC3)CC4=CC=CC=C4)Cl)C5=CC=CC=C5

Isomeric SMILES

CC1=NN(C(=C1C(=O)NC2=CC=C(C=C2)N3CCN(CC3)CC4=CC=CC=C4)Cl)C5=CC=CC=C5

InChI

InChI=1S/C28H28ClN5O/c1-21-26(27(29)34(31-21)25-10-6-3-7-11-25)28(35)30-23-12-14-24(15-13-23)33-18-16-32(17-19-33)20-22-8-4-2-5-9-22/h2-15H,16-20H2,1H3,(H,30,35)