Vitas-M small molecule compound
(2Z)-2-(2,4-dimethoxy-5-nitrobenzylidene)-1-benzothiophen-3(2H)-one
Catalog ID
STK869051
SMILES COc1cc(OC)c(cc1/C=C/1\Sc2c(C1=O)cccc2)[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 C17H13NO5S MW 343.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H13NO5S/c1-22-13-9-14(23-2)12(18(20)21)7-10(13)8-16-17(19)11-5-3-4-6-15(11)24-16/h3-9H,1-2H3/b16-8-InChIKey
ZEDSNFHLRHEPRQ-PXNMLYILSA-NSynonyms
810695-07-9(2Z)2((24DIMETHOXY5NITROPHENYL)METHYLIDENE)1BENZOTHIOPHEN3ONE
(2Z)2(24dimethoxy5nitrobenzylidene)1benzothiophen3(2H)one
(Z)2(24dimethoxy5nitrobenzylidene)benzo(b)thiophen3(2H)one
810695079
COC1=CC(=C(C=C1C=C2C(=O)C3=CC=CC=C3S2)(N+)(=O)(O))OC
COc1cc(OC)c(cc1C=C1Sc2c(C1=O)cccc2)(N+)(=O)(O)
InChI=1SC17H13NO5Sc12213914(232)12(18(20)21)710(13)81617(19)11534615(11)2416h39H12H3b168
MFCD01030545
ZINC000013592300
ZINC13592300
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