3-nitro-N-[2-[[4-(trifluoromethyl)-1H-imidazol-5-yl]methylsulfanyl]ethyl]-1H-pyrrol-2-amine

Systemtic Name: 3-nitro-N-[2-[[4-(trifluoromethyl)-1H-imidazol-5-yl]methylsulfanyl]ethyl]-1H-pyrrol-2-amine Openeye Name: 3-nitro-N-[2-[[4-(trifluoromethyl)-1H-imidazol-5-yl]methylsulfanyl]ethyl]-1H-pyrrol-2-amine CAS Name: 3-nitro-N-[2-[[4-(trifluoromethyl)-1H-imidazol-5-yl]methylthio]ethyl]-1H-pyrrol-2-amine IUPAC Name: 3-nitro-N-[2-[[4-(trifluoromethyl)-1H-imidazol-5-yl]methylsulfanyl]ethyl]-1H-pyrrol-2-amine Traditional Name: (3-nitro-1H-pyrrol-2-yl)-[2-[[4-(trifluoromethyl)-1H-imidazol-5-yl]methylthio]ethyl]amine Formula: C11H12F3N5O2S MolecularWeight: 335.30549

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Descriptors Computed from Structure

Canonical SMILES:

C1=CNC(=C1[N+](=O)[O-])NCCSCC2=C(N=CN2)C(F)(F)F

Isomeric SMILES

C1=CNC(=C1[N+](=O)[O-])NCCSCC2=C(N=CN2)C(F)(F)F

InChI

InChI=1S/C11H12F3N5O2S/c12-11(13,14)9-7(17-6-18-9)5-22-4-3-16-10-8(19(20)21)1-2-15-10/h1-2,6,15-16H,3-5H2,(H,17,18)