Vitas-M small molecule compound
3-(difluoromethyl)-N-[(E)-{5-[(2,3-dihydro-1H-inden-5-yloxy)methyl]furan-2-yl}methylidene]-5-(ethylsulfanyl)-4H-1,2,4-triazol-4-amine
Catalog ID
STL173531
SMILES CCSc1nnc(n1/N=C/c1ccc(o1)COc1ccc2c(c1)CCC2)C(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 C20H20F2N4O2S MW 418.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20F2N4O2S/c1-2-29-20-25-24-19(18(21)22)26(20)23-11-16-8-9-17(28-16)12-27-15-7-6-13-4-3-5-14(13)10-15/h6-11,18H,2-5,12H2,1H3/b23-11+InChIKey
NYJODICXFIQLGK-FOKLQQMPSA-NSynonyms
866564-19-4(E)N(3(difluoromethyl)5ethylsulfanyl124triazol4yl)1(5(23dihydro1Hinden5yloxymethyl)furan2yl)methanimine
3(difluoromethyl)N((E)(5((23dihydro1Hinden5yloxy)methyl)furan2yl)methylidene)5(ethylsulfanyl)4H124triazol4amine
866564194
CCSC1=NN=C(N1N=CC2=CC=C(O2)COC3=CC4=C(CCC4)C=C3)C(F)F
CCSc1nnc(n1N=Cc1ccc(o1)COc1ccc2c(c1)CCC2)C(F)F
InChI=1SC20H20F2N4O2Sc122920252419(18(21)22)26(20)2311168917(2816)122715761343514(13)1015h61118H2512H21H3b2311+
MFCD08553317
ZINC000036611329
ZINC96569764
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