Vitas-M small molecule compound
4-[(2E)-2-(2-chloro-5-nitrobenzylidene)hydrazinyl]-6-(morpholin-4-yl)-N-[3-(trifluoromethyl)phenyl]-1,3,5-triazin-2-amine
Catalog ID
STK669032
SMILES Clc1ccc(cc1/C=N/Nc1nc(Nc2cccc(c2)C(F)(F)F)nc(n1)N1CCOCC1)[N+](=O)[O-]
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C21H18ClF3N8O3 MW 522.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18ClF3N8O3/c22-17-5-4-16(33(34)35)10-13(17)12-26-31-19-28-18(29-20(30-19)32-6-8-36-9-7-32)27-15-3-1-2-14(11-15)21(23,24)25/h1-5,10-12H,6-9H2,(H2,27,28,29,30,31)/b26-12+InChIKey
CGIOZJRCSSVMKW-RPPGKUMJSA-NSynonyms
2N((E)(2chloro5nitrophenyl)methylideneamino)6morpholin4yl4N(3(trifluoromethyl)phenyl)135triazine24diamine
4((2E)2(2chloro5nitrobenzylidene)hydrazinyl)6(morpholin4yl)N(3(trifluoromethyl)phenyl)135triazin2amine
C1COCCN1C2=NC(=NC(=N2)NN=CC3=C(C=CC(=C3)(N+)(=O)(O))Cl)NC4=CC=CC(=C4)C(F)(F)F
Clc1ccc(cc1C=NNc1nc(Nc2cccc(c2)C(F)(F)F)nc(n1)N1CCOCC1)(N+)(=O)(O)
InChI=1SC21H18ClF3N8O3c22175416(33(34)35)1013(17)122631192818(2920(3019)3268369732)271531214(1115)21(2324)25h151012H69H2(H22728293031)b2612+
MFCD00313579
ZINC000008872737
ZINC102773035
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