N-[3-cyano-4-[4-(oxan-4-yl)piperazin-1-yl]phenyl]-5-methyl-1-[4-(trifluoromethyl)phenyl]pyrazole-4-carboxamide

Systemtic Name: N-[3-cyano-4-[4-(oxan-4-yl)piperazin-1-yl]phenyl]-5-methyl-1-[4-(trifluoromethyl)phenyl]pyrazole-4-carboxamide Openeye Name: N-[3-cyano-4-(4-tetrahydropyran-4-ylpiperazin-1-yl)phenyl]-5-methyl-1-[4-(trifluoromethyl)phenyl]pyrazole-4-carboxamide CAS Name: N-[3-cyano-4-[4-(4-oxanyl)-1-piperazinyl]phenyl]-5-methyl-1-[4-(trifluoromethyl)phenyl]-4-pyrazolecarboxamide IUPAC Name: N-[3-cyano-4-[4-(oxan-4-yl)piperazin-1-yl]phenyl]-5-methyl-1-[4-(trifluoromethyl)phenyl]pyrazole-4-carboxamide Traditional Name: N-[3-cyano-4-(4-tetrahydropyran-4-ylpiperazino)phenyl]-5-methyl-1-[4-(trifluoromethyl)phenyl]pyrazole-4-carboxamide Formula: C28H29F3N6O2 MolecularWeight: 538.56407

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1C2=CC=C(C=C2)C(F)(F)F)C(=O)NC3=CC(=C(C=C3)N4CCN(CC4)C5CCOCC5)C#N

Isomeric SMILES

CC1=C(C=NN1C2=CC=C(C=C2)C(F)(F)F)C(=O)NC3=CC(=C(C=C3)N4CCN(CC4)C5CCOCC5)C#N

InChI

InChI=1S/C28H29F3N6O2/c1-19-25(18-33-37(19)24-5-2-21(3-6-24)28(29,30)31)27(38)34-22-4-7-26(20(16-22)17-32)36-12-10-35(11-13-36)23-8-14-39-15-9-23/h2-7,16,18,23H,8-15H2,1H3,(H,34,38)