Vitas-M small molecule compound
2-{[5-(3,4-dimethoxyphenyl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(E)-(2-fluorophenyl)methylidene]acetohydrazide
Catalog ID
STK544084
SMILES COc1cc(ccc1OC)c1nnc(n1CC)SCC(=O)N/N=C/c1ccccc1F
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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 C21H22FN5O3S MW 443.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22FN5O3S/c1-4-27-20(14-9-10-17(29-2)18(11-14)30-3)25-26-21(27)31-13-19(28)24-23-12-15-7-5-6-8-16(15)22/h5-12H,4,13H2,1-3H3,(H,24,28)/b23-12+InChIKey
RHADLZDXVAFMIW-FSJBWODESA-NSynonyms
488123-04-2(E)2((5(34dimethoxyphenyl)4ethyl4H124triazol3yl)thio)N(2fluorobenzylidene)acetohydrazide
2((5(34DIMETHOXYPHENYL)4ETHYL124TRIAZOL3YL)SULFANYL)N((E)(2FLUOROPHENYL)METHYLIDENEAMINO)ACETAMIDE
2((5(34dimethoxyphenyl)4ethyl4H124triazol3yl)sulfanyl)N((E)(2fluorophenyl)methylidene)acetohydrazide
488123042
CCN1C(=NN=C1SCC(=O)NN=CC2=CC=CC=C2F)C3=CC(=C(C=C3)OC)OC
COc1cc(ccc1OC)c1nnc(n1CC)SCC(=O)NN=Cc1ccccc1F
InChI=1SC21H22FN5O3Sc142720(1491017(292)18(1114)303)252621(27)311319(28)24231215756816(15)22h512H413H213H3(H2428)b2312+
MFCD03218604
ZINC000001242998
ZINC33329958
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