Vitas-M small molecule compound
2-{[4-ethyl-5-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(E)-(3-nitrophenyl)methylidene]acetohydrazide
Catalog ID
STL362571
SMILES COc1ccc(cc1)c1nnc(n1CC)SCC(=O)N/N=C/c1cccc(c1)[N+](=O)[O-]
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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 C20H20N6O4S MW 440.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20N6O4S/c1-3-25-19(15-7-9-17(30-2)10-8-15)23-24-20(25)31-13-18(27)22-21-12-14-5-4-6-16(11-14)26(28)29/h4-12H,3,13H2,1-2H3,(H,22,27)/b21-12+InChIKey
TZRDXHLMLXPLKW-CIAFOILYSA-NSynonyms
303102-76-3(E)2((4ethyl5(4methoxyphenyl)4H124triazol3yl)thio)N(3nitrobenzylidene)acetohydrazide
2((4ETHYL5(4METHOXYPHENYL)124TRIAZOL3YL)SULFANYL)N((E)(3NITROPHENYL)METHYLIDENEAMINO)ACETAMIDE
2((4ethyl5(4methoxyphenyl)4H124triazol3yl)sulfanyl)N((E)(3nitrophenyl)methylidene)acetohydrazide
303102763
CCN1C(=NN=C1SCC(=O)NN=CC2=CC(=CC=C2)(N+)(=O)(O))C3=CC=C(C=C3)OC
COc1ccc(cc1)c1nnc(n1CC)SCC(=O)NN=Cc1cccc(c1)(N+)(=O)(O)
InChI=1SC20H20N6O4Sc132519(157917(302)10815)232420(25)311318(27)2221121454616(1114)26(28)29h412H313H212H3(H2227)b2112+
MFCD02021924
N((1E)2(3NITROPHENYL)1AZAVINYL)2(4ETHYL5(4METHOXYPHENYL)(124TRIAZOL3YLTHIO))ACETAMIDE
ZINC000002318170
ZINC33360375
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