N-[(E)-2-(4-methylphenyl)sulfonyl-2-nitro-ethenyl]-5-(trifluoromethyl)pyridin-2-amine

Systemtic Name: N-[(E)-2-(4-methylphenyl)sulfonyl-2-nitro-ethenyl]-5-(trifluoromethyl)pyridin-2-amine Openeye Name: N-[(E)-2-nitro-2-(p-tolylsulfonyl)vinyl]-5-(trifluoromethyl)pyridin-2-amine CAS Name: N-[(E)-2-(4-methylphenyl)sulfonyl-2-nitroethenyl]-5-(trifluoromethyl)-2-pyridinamine IUPAC Name: N-[(E)-2-(4-methylphenyl)sulfonyl-2-nitroethenyl]-5-(trifluoromethyl)pyridin-2-amine Traditional Name: [(E)-2-nitro-2-tosyl-vinyl]-[5-(trifluoromethyl)-2-pyridyl]amine Formula: C15H12F3N3O4S MolecularWeight: 387.33369

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C(=CNC2=NC=C(C=C2)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)/C(=C/NC2=NC=C(C=C2)C(F)(F)F)/[N+](=O)[O-]

InChI

InChI=1S/C15H12F3N3O4S/c1-10-2-5-12(6-3-10)26(24,25)14(21(22)23)9-20-13-7-4-11(8-19-13)15(16,17)18/h2-9H,1H3,(H,19,20)/b14-9+