Vitas-M small molecule compound
2-({4-ethyl-5-[1-methyl-5-(trifluoromethyl)-1H-pyrazol-3-yl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N'-[(E)-(2-fluorophenyl)methylidene]acetohydrazide
Catalog ID
STK302890
SMILES CCn1c(SCC(=O)N/N=C/c2ccccc2F)nnc1c1nn(c(c1)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 C18H17F4N7OS MW 455.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17F4N7OS/c1-3-29-16(13-8-14(18(20,21)22)28(2)27-13)25-26-17(29)31-10-15(30)24-23-9-11-6-4-5-7-12(11)19/h4-9H,3,10H2,1-2H3,(H,24,30)/b23-9+InChIKey
RCCSMOHVQKLCTJ-NUGSKGIGSA-NSynonyms
1005662-57-61005662576
2((4ethyl5(1methyl5(trifluoromethyl)1Hpyrazol3yl)4H124triazol3yl)sulfanyl)N((E)(2fluorophenyl)methylidene)acetohydrazide
2((4ethyl5(1methyl5(trifluoromethyl)pyrazol3yl)124triazol3yl)sulfanyl)N((E)(2fluorophenyl)methylideneamino)acetamide
CCN1C(=NN=C1SCC(=O)NN=CC2=CC=CC=C2F)C3=NN(C(=C3)C(F)(F)F)C
CCn1c(SCC(=O)NN=Cc2ccccc2F)nnc1c1nn(c(c1)C(F)(F)F)C
InChI=1SC18H17F4N7OSc132916(13814(18(2021)22)28(2)2713)252617(29)311015(30)2423911645712(11)19h49H310H212H3(H2430)b239+
MFCD04049046
ZINC000002747876
ZINC35657307
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