PDB CCD ID: | U12 |
Number of entries in BioLiP: | 1 |
Chemical formula: | C10 H7 F3 N6 |
InChI: | InChI=1S/C10H7F3N6/c11-10(12,13)5-2-1-3-6(4-5)16-17-7-8(14)18-19-9(7)15/h1-4,14H,15H2/b14-8?,17-16+ |
InChIKey: | SNTJRGVKGCPNBK-KGQVPBNKSA-N |
SMILES: | Software | SMILES |
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ACDLabs 10.04 | FC(F)(F)c2cccc(/N=N/C=1C(=[N@H])N=NC=1N)c2 | CACTVS 3.341 | NC1=C(N=Nc2cccc(c2)C(F)(F)F)C(=N)N=N1 | OpenEye OEToolkits 1.5.0 | c1cc(cc(c1)/N=N/C2=C(N=NC2=N)N)C(F)(F)F | OpenEye OEToolkits 1.5.0 | c1cc(cc(c1)N=NC2=C(N=NC2=N)N)C(F)(F)F |
|
Name: | 5-IMINO-4-(3-TRIFLUOROMETHYL-PHENYLAZO)-5H-PYRAZOL-3-YLAMINE |
ZINC: | ZINC000014965669 |