2-[3-(aminomethyl)-4-fluoranyl-phenyl]-N-[4-[(Z)-N-methylsulfonyl-C-pyrrolidin-1-yl-carbonimidoyl]phenyl]-5-(trifluoromethyl)pyrazole-3-carboxamide

Systemtic Name: 2-[3-(aminomethyl)-4-fluoranyl-phenyl]-N-[4-[(Z)-N-methylsulfonyl-C-pyrrolidin-1-yl-carbonimidoyl]phenyl]-5-(trifluoromethyl)pyrazole-3-carboxamide Openeye Name: 2-[3-(aminomethyl)-4-fluoro-phenyl]-N-[4-[(Z)-N-methylsulfonyl-C-pyrrolidin-1-yl-carbonimidoyl]phenyl]-5-(trifluoromethyl)pyrazole-3-carboxamide CAS Name: 2-[3-(aminomethyl)-4-fluorophenyl]-N-[4-[(Z)-methylsulfonylimino(1-pyrrolidinyl)methyl]phenyl]-5-(trifluoromethyl)-3-pyrazolecarboxamide IUPAC Name: 2-[3-(aminomethyl)-4-fluorophenyl]-N-[4-[(Z)-N-methylsulfonyl-C-pyrrolidin-1-ylcarbonimidoyl]phenyl]-5-(trifluoromethyl)pyrazole-3-carboxamide Traditional Name: 2-[3-(aminomethyl)-4-fluoro-phenyl]-N-[4-[(Z)-N-mesyl-C-pyrrolidino-carbonimidoyl]phenyl]-5-(trifluoromethyl)pyrazole-3-carboxamide Formula: C24H24F4N6O3S MolecularWeight: 552.544373

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N=C(C1=CC=C(C=C1)NC(=O)C2=CC(=NN2C3=CC(=C(C=C3)F)CN)C(F)(F)F)N4CCCC4

Isomeric SMILES

CS(=O)(=O)/N=C(/C1=CC=C(C=C1)NC(=O)C2=CC(=NN2C3=CC(=C(C=C3)F)CN)C(F)(F)F)\N4CCCC4

InChI

InChI=1S/C24H24F4N6O3S/c1-38(36,37)32-22(33-10-2-3-11-33)15-4-6-17(7-5-15)30-23(35)20-13-21(24(26,27)28)31-34(20)18-8-9-19(25)16(12-18)14-29/h4-9,12-13H,2-3,10-11,14,29H2,1H3,(H,30,35)/b32-22-