Vitas-M small molecule compound
N-{3-[(1E)-1-{2-[(3-chloro-6-ethyl-1-benzothiophen-2-yl)carbonyl]hydrazinylidene}ethyl]phenyl}-2,2,2-trifluoroacetamide
Catalog ID
STK468309
SMILES CCc1ccc2c(c1)sc(c2Cl)C(=O)N/N=C(/c1cccc(c1)NC(=O)C(F)(F)F)\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 C21H17ClF3N3O2S MW 467.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17ClF3N3O2S/c1-3-12-7-8-15-16(9-12)31-18(17(15)22)19(29)28-27-11(2)13-5-4-6-14(10-13)26-20(30)21(23,24)25/h4-10H,3H2,1-2H3,(H,26,30)(H,28,29)/b27-11+InChIKey
QUPNLMYFDHCGNJ-LUOAPIJWSA-NSynonyms
3chloro6ethylN((E)1(3((222trifluoroacetyl)amino)phenyl)ethylideneamino)1benzothiophene2carboxamide
CCC1=CC2=C(C=C1)C(=C(S2)C(=O)NN=C(C)C3=CC(=CC=C3)NC(=O)C(F)(F)F)Cl
CCc1ccc2c(c1)sc(c2Cl)C(=O)NN=C(c1cccc(c1)NC(=O)C(F)(F)F)C
InChI=1SC21H17ClF3N3O2Sc1312781516(912)3118(17(15)22)19(29)282711(2)1354614(1013)2620(30)21(2324)25h410H3H212H3(H2630)(H2829)b2711+
MFCD07182529
N(3((1E)1(2((3chloro6ethyl1benzothiophen2yl)carbonyl)hydrazinylidene)ethyl)phenyl)222trifluoroacetamide
N(3((1E)2((3CHLORO6ETHYLBENZO(B)THIOPHEN2YL)CARBONYLAMINO)1METHYL2AZAVINYL)PHENYL)222TRIFLUOROACETAMIDE
ZINC000020213287
ZINC96438342
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