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

Systemtic Name: N-(4,5-dimethyl-1,3-thiazol-2-yl)-1-[2-nitro-4-(trifluoromethyl)phenyl]piperidine-4-carboxamide Openeye Name: N-(4,5-dimethylthiazol-2-yl)-1-[2-nitro-4-(trifluoromethyl)phenyl]piperidine-4-carboxamide CAS Name: N-(4,5-dimethyl-2-thiazolyl)-1-[2-nitro-4-(trifluoromethyl)phenyl]-4-piperidinecarboxamide IUPAC Name: N-(4,5-dimethyl-1,3-thiazol-2-yl)-1-[2-nitro-4-(trifluoromethyl)phenyl]piperidine-4-carboxamide Traditional Name: N-(4,5-dimethylthiazol-2-yl)-1-[2-nitro-4-(trifluoromethyl)phenyl]isonipecotamide Formula: C18H19F3N4O3S MolecularWeight: 428.42867

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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-])C

Isomeric SMILES

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

InChI

InChI=1S/C18H19F3N4O3S/c1-10-11(2)29-17(22-10)23-16(26)12-5-7-24(8-6-12)14-4-3-13(18(19,20)21)9-15(14)25(27)28/h3-4,9,12H,5-8H2,1-2H3,(H,22,23,26)