N-[4-(4-ethylpiperazin-1-yl)-3-methyl-phenyl]-1-(6-methoxypyridazin-3-yl)-5-(trifluoromethyl)pyrazole-4-carboxamide

Systemtic Name: N-[4-(4-ethylpiperazin-1-yl)-3-methyl-phenyl]-1-(6-methoxypyridazin-3-yl)-5-(trifluoromethyl)pyrazole-4-carboxamide Openeye Name: N-[4-(4-ethylpiperazin-1-yl)-3-methyl-phenyl]-1-(6-methoxypyridazin-3-yl)-5-(trifluoromethyl)pyrazole-4-carboxamide CAS Name: N-[4-(4-ethyl-1-piperazinyl)-3-methylphenyl]-1-(6-methoxy-3-pyridazinyl)-5-(trifluoromethyl)-4-pyrazolecarboxamide IUPAC Name: N-[4-(4-ethylpiperazin-1-yl)-3-methylphenyl]-1-(6-methoxypyridazin-3-yl)-5-(trifluoromethyl)pyrazole-4-carboxamide Traditional Name: N-[4-(4-ethylpiperazino)-3-methyl-phenyl]-1-(6-methoxypyridazin-3-yl)-5-(trifluoromethyl)pyrazole-4-carboxamide Formula: C23H26F3N7O2 MolecularWeight: 489.49345

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=C(C=C(C=C2)NC(=O)C3=C(N(N=C3)C4=NN=C(C=C4)OC)C(F)(F)F)C

Isomeric SMILES

CCN1CCN(CC1)C2=C(C=C(C=C2)NC(=O)C3=C(N(N=C3)C4=NN=C(C=C4)OC)C(F)(F)F)C

InChI

InChI=1S/C23H26F3N7O2/c1-4-31-9-11-32(12-10-31)18-6-5-16(13-15(18)2)28-22(34)17-14-27-33(21(17)23(24,25)26)19-7-8-20(35-3)30-29-19/h5-8,13-14H,4,9-12H2,1-3H3,(H,28,34)