Vitas-M small molecule compound
(2E)-2-{2-[2-(3-ethyl-5-methylphenoxy)ethoxy]-5-nitrobenzylidene}-N-methylhydrazinecarbothioamide
Catalog ID
STK380482
SMILES CNC(=S)N/N=C/c1cc(ccc1OCCOc1cc(C)cc(c1)CC)[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/c1-4-15-9-14(2)10-18(11-15)27-7-8-28-19-6-5-17(24(25)26)12-16(19)13-22-23-20(29)21-3/h5-6,9-13H,4,7-8H2,1-3H3,(H2,21,23,29)/b22-13+InChIKey
HACMFEZKMFLRSR-LPYMAVHISA-NSynonyms
(((1E)2(2(2(5ETHYL3METHYLPHENOXY)ETHOXY)5NITROPHENYL)1AZAVINYL)AMINO)(METHYLAMINO)METHANE1THIONE
(2E)2(2(2(3ethyl5methylphenoxy)ethoxy)5nitrobenzylidene)Nmethylhydrazinecarbothioamide
1((E)(2(2(3ethyl5methylphenoxy)ethoxy)5nitrophenyl)methylideneamino)3methylthiourea
CCC1=CC(=CC(=C1)C)OCCOC2=C(C=C(C=C2)(N+)(=O)(O))C=NNC(=S)NC
CNC(=S)NN=Cc1cc(ccc1OCCOc1cc(C)cc(c1)CC)(N+)(=O)(O)
InChI=1SC20H24N4O4Sc1415914(2)1018(1115)277828196517(24(25)26)1216(19)13222320(29)213h56913H478H213H3(H2212329)b2213+
MFCD02126988
ZINC000004512558
ZINC34377909
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