Vitas-M small molecule compound
N'-[(E)-(2,4-dimethoxyphenyl)methylidene]-2-{[4-methyl-5-(3-nitrophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetohydrazide
Catalog ID
STL339413
SMILES COc1ccc(c(c1)OC)/C=N/NC(=O)CSc1nnc(n1C)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 C20H20N6O5S MW 456.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20N6O5S/c1-25-19(13-5-4-6-15(9-13)26(28)29)23-24-20(25)32-12-18(27)22-21-11-14-7-8-16(30-2)10-17(14)31-3/h4-11H,12H2,1-3H3,(H,22,27)/b21-11+InChIKey
XIHYUDUZHYWKEJ-SRZZPIQSSA-NSynonyms
347908-72-9(E)N(24dimethoxybenzylidene)2((4methyl5(3nitrophenyl)4H124triazol3yl)thio)acetohydrazide
347908729
CN1C(=NN=C1SCC(=O)NN=CC2=C(C=C(C=C2)OC)OC)C3=CC(=CC=C3)(N+)(=O)(O)
COc1ccc(c(c1)OC)C=NNC(=O)CSc1nnc(n1C)c1cccc(c1)(N+)(=O)(O)
InChI=1SC20H20N6O5Sc12519(1354615(913)26(28)29)232420(25)321218(27)222111147816(302)1017(14)313h411H12H213H3(H2227)b2111+
MFCD02609876
N((E)(24dimethoxyphenyl)methylidene)2((4methyl5(3nitrophenyl)4H124triazol3yl)sulfanyl)acetohydrazide
N((E)(24DIMETHOXYPHENYL)METHYLIDENEAMINO)2((4METHYL5(3NITROPHENYL)124TRIAZOL3YL)SULFANYL)ACETAMIDE
ZINC000001840573
ZINC33345342
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