Vitas-M small molecule compound
2-{[5-(3,4-dimethoxyphenyl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(E)-(4-nitrophenyl)methylidene]acetohydrazide
Catalog ID
STK542247
SMILES CCn1c(SCC(=O)N/N=C/c2ccc(cc2)[N+](=O)[O-])nnc1c1ccc(c(c1)OC)OC
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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 C21H22N6O5S MW 470.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N6O5S/c1-4-26-20(15-7-10-17(31-2)18(11-15)32-3)24-25-21(26)33-13-19(28)23-22-12-14-5-8-16(9-6-14)27(29)30/h5-12H,4,13H2,1-3H3,(H,23,28)/b22-12+InChIKey
JZQONCDWKHARQP-WSDLNYQXSA-NSynonyms
489416-21-9(E)2((5(34dimethoxyphenyl)4ethyl4H124triazol3yl)thio)N(4nitrobenzylidene)acetohydrazide
2((5(34dimethoxyphenyl)4ethyl124triazol3yl)sulfanyl)N((E)(4nitrophenyl)methylideneamino)acetamide
2((5(34dimethoxyphenyl)4ethyl4H124triazol3yl)sulfanyl)N((E)(4nitrophenyl)methylidene)acetohydrazide
489416219
CCN1C(=NN=C1SCC(=O)NN=CC2=CC=C(C=C2)(N+)(=O)(O))C3=CC(=C(C=C3)OC)OC
CCn1c(SCC(=O)NN=Cc2ccc(cc2)(N+)(=O)(O))nnc1c1ccc(c(c1)OC)OC
InChI=1SC21H22N6O5Sc142620(1571017(312)18(1115)323)242521(26)331319(28)232212145816(9614)27(29)30h512H413H213H3(H2328)b2212+
MFCD03218547
ZINC000013584061
ZINC33914397
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