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

Systemtic Name: N-(4-methyl-1,3-thiazol-2-yl)-1-[2-nitro-4-(trifluoromethyl)phenyl]piperidine-4-carboxamide Openeye Name: N-(4-methylthiazol-2-yl)-1-[2-nitro-4-(trifluoromethyl)phenyl]piperidine-4-carboxamide CAS Name: N-(4-methyl-2-thiazolyl)-1-[2-nitro-4-(trifluoromethyl)phenyl]-4-piperidinecarboxamide IUPAC Name: N-(4-methyl-1,3-thiazol-2-yl)-1-[2-nitro-4-(trifluoromethyl)phenyl]piperidine-4-carboxamide Traditional Name: N-(4-methylthiazol-2-yl)-1-[2-nitro-4-(trifluoromethyl)phenyl]isonipecotamide Formula: C17H17F3N4O3S MolecularWeight: 414.40209

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H17F3N4O3S/c1-10-9-28-16(21-10)22-15(25)11-4-6-23(7-5-11)13-3-2-12(17(18,19)20)8-14(13)24(26)27/h2-3,8-9,11H,4-7H2,1H3,(H,21,22,25)