Vitas-M small molecule compound
N'-{(E)-[3-methoxy-4-(propan-2-yloxy)phenyl]methylidene}-2-{[4-methyl-5-(3-nitrophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetohydrazide
Catalog ID
STK556143
SMILES COc1cc(/C=N/NC(=O)CSc2nnc(n2C)c2cccc(c2)[N+](=O)[O-])ccc1OC(C)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 C22H24N6O5S MW 484.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H24N6O5S/c1-14(2)33-18-9-8-15(10-19(18)32-4)12-23-24-20(29)13-34-22-26-25-21(27(22)3)16-6-5-7-17(11-16)28(30)31/h5-12,14H,13H2,1-4H3,(H,24,29)/b23-12+InChIKey
MGBJWGKOQKZMAB-FSJBWODESA-NSynonyms
348592-29-0(E)N(4isopropoxy3methoxybenzylidene)2((4methyl5(3nitrophenyl)4H124triazol3yl)thio)acetohydrazide
348592290
CC(C)OC1=C(C=C(C=C1)C=NNC(=O)CSC2=NN=C(N2C)C3=CC(=CC=C3)(N+)(=O)(O))OC
COc1cc(C=NNC(=O)CSc2nnc(n2C)c2cccc(c2)(N+)(=O)(O))ccc1OC(C)C
InChI=1SC22H24N6O5Sc114(2)33189815(1019(18)324)12232420(29)133422262521(27(22)3)1665717(1116)28(30)31h51214H13H214H3(H2429)b2312+
MFCD02611387
N((E)(3methoxy4(propan2yloxy)phenyl)methylidene)2((4methyl5(3nitrophenyl)4H124triazol3yl)sulfanyl)acetohydrazide
N((E)(3METHOXY4PROPAN2YLOXYPHENYL)METHYLIDENEAMINO)2((4METHYL5(3NITROPHENYL)124TRIAZOL3YL)SULFANYL)ACETAMIDE
ZINC000001856893
ZINC33345585
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