Vitas-M small molecule compound
(2E)-3-(4,7-dimethoxy-1,3-benzodioxol-5-yl)-1-(thiophen-2-yl)prop-2-en-1-one
Catalog ID
STK693243
SMILES COc1c(/C=C/C(=O)c2cccs2)cc(c2c1OCO2)OC
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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 C16H14O5S MW 318.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H14O5S/c1-18-12-8-10(5-6-11(17)13-4-3-7-22-13)14(19-2)16-15(12)20-9-21-16/h3-8H,9H2,1-2H3/b6-5+InChIKey
OCFOHMAZMDECES-AATRIKPKSA-NSynonyms
(2E)3(47DIMETHOXY(2HBENZO(D)13DIOXOLEN5YL))1(2THIENYL)PROP2EN1ONE
(2E)3(47dimethoxy13benzodioxol5yl)1(thiophen2yl)prop2en1one
(E)3(47dimethoxy13benzodioxol5yl)1thiophen2ylprop2en1one
COC1=C2C(=C(C(=C1)C=CC(=O)C3=CC=CS3)OC)OCO2
COc1c(C=CC(=O)c2cccs2)cc(c2c1OCO2)OC
InChI=1SC16H14O5Sc11812810(5611(17)134372213)14(192)1615(12)2092116h38H9H212H3b65+
MFCD10039339
ZINC000015106080
ZINC15106080
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