Vitas-M small molecule compound
(2E)-2-{3-ethoxy-4-[(4-nitrobenzyl)oxy]benzylidene}-N-methylhydrazinecarbothioamide
Catalog ID
STL380242
SMILES CCOc1cc(/C=N/NC(=S)NC)ccc1OCc1ccc(cc1)[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 C18H20N4O4S MW 388.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H20N4O4S/c1-3-25-17-10-14(11-20-21-18(27)19-2)6-9-16(17)26-12-13-4-7-15(8-5-13)22(23)24/h4-11H,3,12H2,1-2H3,(H2,19,21,27)/b20-11+InChIKey
AJBZATSJMXFOHS-RGVLZGJSSA-NSynonyms
(2E)2(3ethoxy4((4nitrobenzyl)oxy)benzylidene)Nmethylhydrazinecarbothioamide
1((E)(3ETHOXY4((4NITROPHENYL)METHOXY)PHENYL)METHYLIDENEAMINO)3METHYLTHIOUREA
CCOC1=C(C=CC(=C1)C=NNC(=S)NC)OCC2=CC=C(C=C2)(N+)(=O)(O)
CCOc1cc(C=NNC(=S)NC)ccc1OCc1ccc(cc1)(N+)(=O)(O)
InChI=1SC18H20N4O4Sc1325171014(11202118(27)192)6916(17)2612134715(8513)22(23)24h411H312H212H3(H2192127)b2011+
MFCD03863587
ZINC000000980731
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