1-(4-chlorophenyl)-N-[3-cyano-4-[4-(4-ethanoylpiperazin-1-yl)piperidin-1-yl]phenyl]-5-methyl-pyrazole-4-carboxamide

Systemtic Name: 1-(4-chlorophenyl)-N-[3-cyano-4-[4-(4-ethanoylpiperazin-1-yl)piperidin-1-yl]phenyl]-5-methyl-pyrazole-4-carboxamide Openeye Name: N-[4-[4-(4-acetylpiperazin-1-yl)-1-piperidyl]-3-cyano-phenyl]-1-(4-chlorophenyl)-5-methyl-pyrazole-4-carboxamide CAS Name: N-[4-[4-(4-acetyl-1-piperazinyl)-1-piperidinyl]-3-cyanophenyl]-1-(4-chlorophenyl)-5-methyl-4-pyrazolecarboxamide IUPAC Name: N-[4-[4-(4-acetylpiperazin-1-yl)piperidin-1-yl]-3-cyanophenyl]-1-(4-chlorophenyl)-5-methylpyrazole-4-carboxamide Traditional Name: N-[4-[4-(4-acetylpiperazino)piperidino]-3-cyano-phenyl]-1-(4-chlorophenyl)-5-methyl-pyrazole-4-carboxamide Formula: C29H32ClN7O2 MolecularWeight: 546.06308

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1C2=CC=C(C=C2)Cl)C(=O)NC3=CC(=C(C=C3)N4CCC(CC4)N5CCN(CC5)C(=O)C)C#N

Isomeric SMILES

CC1=C(C=NN1C2=CC=C(C=C2)Cl)C(=O)NC3=CC(=C(C=C3)N4CCC(CC4)N5CCN(CC5)C(=O)C)C#N

InChI

InChI=1S/C29H32ClN7O2/c1-20-27(19-32-37(20)26-6-3-23(30)4-7-26)29(39)33-24-5-8-28(22(17-24)18-31)36-11-9-25(10-12-36)35-15-13-34(14-16-35)21(2)38/h3-8,17,19,25H,9-16H2,1-2H3,(H,33,39)