Vitas-M small molecule compound
(2E)-2-(2-{2-[5-methyl-2-(propan-2-yl)phenoxy]ethoxy}-5-nitrobenzylidene)hydrazinecarbothioamide
Catalog ID
STK085803
SMILES NC(=S)N/N=C/c1cc(ccc1OCCOc1cc(C)ccc1C(C)C)[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 C20H24N4O4S MW 416.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H24N4O4S/c1-13(2)17-6-4-14(3)10-19(17)28-9-8-27-18-7-5-16(24(25)26)11-15(18)12-22-23-20(21)29/h4-7,10-13H,8-9H2,1-3H3,(H3,21,23,29)/b22-12+InChIKey
LZMVBTOEWSGSLP-WSDLNYQXSA-NSynonyms
((E)(2(2(5methyl2propan2ylphenoxy)ethoxy)5nitrophenyl)methylideneamino)thiourea
(2E)2(2(2(5METHYL2(PROPAN2YL)PHENOXY)ETHOXY)5NITROBENZYLIDENE)HYDRAZINECARBOTHIOAMIDE
CC1=CC(=C(C=C1)C(C)C)OCCOC2=C(C=C(C=C2)(N+)(=O)(O))C=NNC(=S)N
InChI=1SC20H24N4O4Sc113(2)176414(3)1019(17)289827187516(24(25)26)1115(18)12222320(21)29h471013H89H213H3(H3212329)b2212+
MFCD02126985
NC(=S)NN=Cc1cc(ccc1OCCOc1cc(C)ccc1C(C)C)(N+)(=O)(O)
STK085803
ZINC000004512550
ZINC38196124
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