N-[(6-pyrazol-1-ylpyridin-3-yl)methyl]-4-[4-(trifluoromethyl)phenyl]sulfonyl-piperazine-1-carboxamide

Systemtic Name: N-[(6-pyrazol-1-ylpyridin-3-yl)methyl]-4-[4-(trifluoromethyl)phenyl]sulfonyl-piperazine-1-carboxamide Openeye Name: N-[(6-pyrazol-1-yl-3-pyridyl)methyl]-4-[4-(trifluoromethyl)phenyl]sulfonyl-piperazine-1-carboxamide CAS Name: N-[[6-(1-pyrazolyl)-3-pyridinyl]methyl]-4-[4-(trifluoromethyl)phenyl]sulfonyl-1-piperazinecarboxamide IUPAC Name: N-[(6-pyrazol-1-ylpyridin-3-yl)methyl]-4-[4-(trifluoromethyl)phenyl]sulfonylpiperazine-1-carboxamide Traditional Name: N-[(6-pyrazol-1-yl-3-pyridyl)methyl]-4-[4-(trifluoromethyl)phenyl]sulfonyl-piperazine-1-carboxamide Formula: C21H21F3N6O3S MolecularWeight: 494.49005

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)NCC2=CN=C(C=C2)N3C=CC=N3)S(=O)(=O)C4=CC=C(C=C4)C(F)(F)F

Isomeric SMILES

C1CN(CCN1C(=O)NCC2=CN=C(C=C2)N3C=CC=N3)S(=O)(=O)C4=CC=C(C=C4)C(F)(F)F

InChI

InChI=1S/C21H21F3N6O3S/c22-21(23,24)17-3-5-18(6-4-17)34(32,33)29-12-10-28(11-13-29)20(31)26-15-16-2-7-19(25-14-16)30-9-1-8-27-30/h1-9,14H,10-13,15H2,(H,26,31)