N-(4-methyl-5-pyridin-2-yl-1,3-thiazol-2-yl)-1-[2-nitro-4-(trifluoromethyl)phenyl]piperidine-4-carboxamide

Systemtic Name: N-(4-methyl-5-pyridin-2-yl-1,3-thiazol-2-yl)-1-[2-nitro-4-(trifluoromethyl)phenyl]piperidine-4-carboxamide Openeye Name: N-[4-methyl-5-(2-pyridyl)thiazol-2-yl]-1-[2-nitro-4-(trifluoromethyl)phenyl]piperidine-4-carboxamide CAS Name: N-[4-methyl-5-(2-pyridinyl)-2-thiazolyl]-1-[2-nitro-4-(trifluoromethyl)phenyl]-4-piperidinecarboxamide IUPAC Name: N-(4-methyl-5-pyridin-2-yl-1,3-thiazol-2-yl)-1-[2-nitro-4-(trifluoromethyl)phenyl]piperidine-4-carboxamide Traditional Name: N-[4-methyl-5-(2-pyridyl)thiazol-2-yl]-1-[2-nitro-4-(trifluoromethyl)phenyl]isonipecotamide Formula: C22H20F3N5O3S MolecularWeight: 491.48611

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)NC(=O)C2CCN(CC2)C3=C(C=C(C=C3)C(F)(F)F)[N+](=O)[O-])C4=CC=CC=N4

Isomeric SMILES

CC1=C(SC(=N1)NC(=O)C2CCN(CC2)C3=C(C=C(C=C3)C(F)(F)F)[N+](=O)[O-])C4=CC=CC=N4

InChI

InChI=1S/C22H20F3N5O3S/c1-13-19(16-4-2-3-9-26-16)34-21(27-13)28-20(31)14-7-10-29(11-8-14)17-6-5-15(22(23,24)25)12-18(17)30(32)33/h2-6,9,12,14H,7-8,10-11H2,1H3,(H,27,28,31)