3-ethyl-4-(3-nitrophenyl)-N-[3-(trifluoromethyl)phenyl]-1,3-thiazol-3-ium-2-amine

Systemtic Name: 3-ethyl-4-(3-nitrophenyl)-N-[3-(trifluoromethyl)phenyl]-1,3-thiazol-3-ium-2-amine Openeye Name: 3-ethyl-4-(3-nitrophenyl)-N-[3-(trifluoromethyl)phenyl]thiazol-3-ium-2-amine CAS Name: 3-ethyl-4-(3-nitrophenyl)-N-[3-(trifluoromethyl)phenyl]-2-thiazol-3-iumamine IUPAC Name: 3-ethyl-4-(3-nitrophenyl)-N-[3-(trifluoromethyl)phenyl]-1,3-thiazol-3-ium-2-amine Traditional Name: [3-ethyl-4-(3-nitrophenyl)thiazol-3-ium-2-yl]-[3-(trifluoromethyl)phenyl]amine Formula: C18H15F3N3O2S+ MolecularWeight: 394.39081

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1=C(SC=C1C2=CC(=CC=C2)[N+](=O)[O-])NC3=CC=CC(=C3)C(F)(F)F

Isomeric SMILES

CC[N+]1=C(SC=C1C2=CC(=CC=C2)[N+](=O)[O-])NC3=CC=CC(=C3)C(F)(F)F

InChI

InChI=1S/C18H14F3N3O2S/c1-2-23-16(12-5-3-8-15(9-12)24(25)26)11-27-17(23)22-14-7-4-6-13(10-14)18(19,20)21/h3-11H,2H2,1H3/p+1