N-[2-(4-methylpiperazin-1-yl)-5-methylsulfonyl-phenyl]-1-[5-(trifluoromethyl)pyridin-2-yl]piperidine-4-carboxamide

Systemtic Name: N-[2-(4-methylpiperazin-1-yl)-5-methylsulfonyl-phenyl]-1-[5-(trifluoromethyl)pyridin-2-yl]piperidine-4-carboxamide Openeye Name: N-[2-(4-methylpiperazin-1-yl)-5-methylsulfonyl-phenyl]-1-[5-(trifluoromethyl)-2-pyridyl]piperidine-4-carboxamide CAS Name: N-[2-(4-methyl-1-piperazinyl)-5-methylsulfonylphenyl]-1-[5-(trifluoromethyl)-2-pyridinyl]-4-piperidinecarboxamide IUPAC Name: N-[2-(4-methylpiperazin-1-yl)-5-methylsulfonylphenyl]-1-[5-(trifluoromethyl)pyridin-2-yl]piperidine-4-carboxamide Traditional Name: N-[5-mesyl-2-(4-methylpiperazino)phenyl]-1-[5-(trifluoromethyl)-2-pyridyl]isonipecotamide Formula: C24H30F3N5O3S MolecularWeight: 525.58691

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=C(C=C(C=C2)S(=O)(=O)C)NC(=O)C3CCN(CC3)C4=NC=C(C=C4)C(F)(F)F

Isomeric SMILES

CN1CCN(CC1)C2=C(C=C(C=C2)S(=O)(=O)C)NC(=O)C3CCN(CC3)C4=NC=C(C=C4)C(F)(F)F

InChI

InChI=1S/C24H30F3N5O3S/c1-30-11-13-31(14-12-30)21-5-4-19(36(2,34)35)15-20(21)29-23(33)17-7-9-32(10-8-17)22-6-3-18(16-28-22)24(25,26)27/h3-6,15-17H,7-14H2,1-2H3,(H,29,33)