Vitas-M small molecule compound
N-(2-{(2E)-2-[1-(4-tert-butylphenyl)ethylidene]hydrazinyl}-2-oxoethyl)-N-[2-chloro-5-(trifluoromethyl)phenyl]methanesulfonamide (non-preferred name)
Catalog ID
STL113845
SMILES O=C(CN(S(=O)(=O)C)c1cc(ccc1Cl)C(F)(F)F)N/N=C(/c1ccc(cc1)C(C)(C)C)\C
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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 C22H25ClF3N3O3S MW 503.97 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H25ClF3N3O3S/c1-14(15-6-8-16(9-7-15)21(2,3)4)27-28-20(30)13-29(33(5,31)32)19-12-17(22(24,25)26)10-11-18(19)23/h6-12H,13H2,1-5H3,(H,28,30)/b27-14+InChIKey
JTQURBMONQWMAW-MZJWZYIUSA-NSynonyms
CC(=NNC(=O)CN(C1=C(C=CC(=C1)C(F)(F)F)Cl)S(=O)(=O)C)C2=CC=C(C=C2)C(C)(C)C
InChI=1SC22H25ClF3N3O3Sc114(156816(9715)21(23)4)272820(30)1329(33(531)32)191217(22(2425)26)101118(19)23h612H13H215H3(H2830)b2714+
MFCD03556115
N((E)1(4tertbutylphenyl)ethylideneamino)2(2chloroNmethylsulfonyl5(trifluoromethyl)anilino)acetamide
N(2((2E)2(1(4tertbutylphenyl)ethylidene)hydrazinyl)2oxoethyl)N(2chloro5(trifluoromethyl)phenyl)methanesulfonamide(nonpreferredname)
O=C(CN(S(=O)(=O)C)c1cc(ccc1Cl)C(F)(F)F)NN=C(c1ccc(cc1)C(C)(C)C)C
ZINC000015231327
ZINC34379883
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