Vitas-M small molecule compound
methyl 2-methyl-3-{5-[(E)-(2-{[3-(trifluoromethyl)phenyl]carbonyl}hydrazinylidene)methyl]furan-2-yl}benzoate
Catalog ID
STK198351
SMILES COC(=O)c1cccc(c1C)c1ccc(o1)/C=N/NC(=O)c1cccc(c1)C(F)(F)F
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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 C22H17F3N2O4 MW 430.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H17F3N2O4/c1-13-17(7-4-8-18(13)21(29)30-2)19-10-9-16(31-19)12-26-27-20(28)14-5-3-6-15(11-14)22(23,24)25/h3-12H,1-2H3,(H,27,28)/b26-12+InChIKey
NLGRDPHQHPSYRG-RPPGKUMJSA-NSynonyms
CC1=C(C=CC=C1C(=O)OC)C2=CC=C(O2)C=NNC(=O)C3=CC(=CC=C3)C(F)(F)F
COC(=O)c1cccc(c1C)c1ccc(o1)C=NNC(=O)c1cccc(c1)C(F)(F)F
InChI=1SC22H17F3N2O4c11317(74818(13)21(29)302)1910916(3119)12262720(28)1453615(1114)22(2324)25h312H12H3(H2728)b2612+
methyl2methyl3(5((E)((3(trifluoromethyl)benzoyl)hydrazinylidene)methyl)furan2yl)benzoate
METHYL2METHYL3(5((E)(2((3(TRIFLUOROMETHYL)PHENYL)CARBONYL)HYDRAZINYLIDENE)METHYL)FURAN2YL)BENZOATE
METHYL3(5((1E)2((3(TRIFLUOROMETHYL)PHENYL)CARBONYLAMINO)2AZAVINYL)(2FURYL))2METHYLBENZOATE
MFCD03060391
ZINC000008721770
ZINC34379541
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