Vitas-M small molecule compound
4-chloro-N'-{(E)-[3-({[4-(difluoromethyl)-6-methylpyrimidin-2-yl]sulfanyl}methyl)-4-methoxyphenyl]methylidene}-2-hydroxybenzohydrazide
Catalog ID
STK465569
SMILES COc1ccc(cc1CSc1nc(C)cc(n1)C(F)F)/C=N/NC(=O)c1ccc(cc1O)Cl
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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 C22H19ClF2N4O3S MW 492.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H19ClF2N4O3S/c1-12-7-17(20(24)25)28-22(27-12)33-11-14-8-13(3-6-19(14)32-2)10-26-29-21(31)16-5-4-15(23)9-18(16)30/h3-10,20,30H,11H2,1-2H3,(H,29,31)/b26-10+InChIKey
YZENKXASWNMOIO-NSKAYECMSA-NSynonyms
4chloroN((E)(3(((4(difluoromethyl)6methylpyrimidin2yl)sulfanyl)methyl)4methoxyphenyl)methylidene)2hydroxybenzohydrazide
4chloroN((E)(3((4(difluoromethyl)6methylpyrimidin2yl)sulfanylmethyl)4methoxyphenyl)methylideneamino)2hydroxybenzamide
CC1=CC(=NC(=N1)SCC2=C(C=CC(=C2)C=NNC(=O)C3=C(C=C(C=C3)Cl)O)OC)C(F)F
COc1ccc(cc1CSc1nc(C)cc(n1)C(F)F)C=NNC(=O)c1ccc(cc1O)Cl
InChI=1SC22H19ClF2N4O3Sc112717(20(24)25)2822(2712)331114813(3619(14)322)10262921(31)165415(23)918(16)30h3102030H11H212H3(H2931)b2610+
MFCD06758277
N((1E)2(3((6(DIFLUOROMETHYL)4METHYLPYRIMIDIN2YLTHIO)METHYL)4METHOXYPHENYL)1AZAVINYL)(4CHLORO2HYDROXYPHENYL)CARBOXAMIDE
ZINC000020353464
ZINC96438219
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