Vitas-M small molecule compound
N-cyclohexyl-2-{[(E)-(2-hydroxy-5-nitrophenyl)methylidene]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Catalog ID
STL505863
SMILES O=C(c1c(/N=C/c2cc(ccc2O)[N+](=O)[O-])sc2c1CCCC2)NC1CCCCC1
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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 C22H25N3O4S MW 427.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H25N3O4S/c26-18-11-10-16(25(28)29)12-14(18)13-23-22-20(17-8-4-5-9-19(17)30-22)21(27)24-15-6-2-1-3-7-15/h10-13,15,26H,1-9H2,(H,24,27)/b23-13+InChIKey
JUEDOQUYRKQPSB-YDZHTSKRSA-NSynonyms
~(N)cyclohexyl2((~(E))(2hydroxy5nitrophenyl)methylideneamino)4567tetrahydro1benzothiophene3carboxamide
135628218
InChI=1SC22H25N3O4Sc2618111016(25(28)29)1214(18)13232220(17845919(17)3022)21(27)24156213715h10131526H19H2(H2427)b2313+
MFCD05149888
Ncyclohexyl2(((E)(2hydroxy5nitrophenyl)methylidene)amino)4567tetrahydro1benzothiophene3carboxamide
ZINC000003766348
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