Vitas-M small molecule compound
5-chloro-N'-{(Z)-[3-({[3-cyano-6-(difluoromethyl)-4-methylpyridin-2-yl]sulfanyl}methyl)-4-methoxyphenyl]methylidene}thiophene-2-carbohydrazide
Catalog ID
STK465576
SMILES COc1ccc(cc1CSc1nc(cc(c1C#N)C)C(F)F)/C=N\NC(=O)c1ccc(s1)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 C22H17ClF2N4O2S2 MW 506.98 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H17ClF2N4O2S2/c1-12-7-16(20(24)25)28-22(15(12)9-26)32-11-14-8-13(3-4-17(14)31-2)10-27-29-21(30)18-5-6-19(23)33-18/h3-8,10,20H,11H2,1-2H3,(H,29,30)/b27-10-InChIKey
CAGWSOTUCLPOPM-NCAUGAEKSA-NSynonyms
5chloroN((Z)(3(((3cyano6(difluoromethyl)4methylpyridin2yl)sulfanyl)methyl)4methoxyphenyl)methylidene)thiophene2carbohydrazide
5chloroN((Z)(3((3cyano6(difluoromethyl)4methylpyridin2yl)sulfanylmethyl)4methoxyphenyl)methylideneamino)thiophene2carboxamide
CC1=CC(=NC(=C1C#N)SCC2=C(C=CC(=C2)C=NNC(=O)C3=CC=C(S3)Cl)OC)C(F)F
COc1ccc(cc1CSc1nc(cc(c1C#N)C)C(F)F)C=NNC(=O)c1ccc(s1)Cl
InChI=1SC22H17ClF2N4O2S2c112716(20(24)25)2822(15(12)926)321114813(3417(14)312)10272921(30)185619(23)3318h381020H11H212H3(H2930)b2710
MFCD09597310
N((1Z)2(3((6(DIFLUOROMETHYL)3CYANO4METHYL(2PYRIDYLTHIO))METHYL)4METHOXYPHENYL)1AZAVINYL)(5CHLORO(2THIENYL))CARBOXAMIDE
ZINC000032577070
ZINC20353185
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