Vitas-M small molecule compound
(2E)-3-(3,4-dimethoxyphenyl)-1-[2-(methylsulfanyl)-1H-benzimidazol-1-yl]prop-2-en-1-one
Catalog ID
STK807177
SMILES COc1cc(/C=C/C(=O)n2c(SC)nc3c2cccc3)ccc1OC
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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 C19H18N2O3S MW 354.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H18N2O3S/c1-23-16-10-8-13(12-17(16)24-2)9-11-18(22)21-15-7-5-4-6-14(15)20-19(21)25-3/h4-12H,1-3H3/b11-9+InChIKey
MKSYZAUUGFXDHI-PKNBQFBNSA-NSynonyms
(2E)3(34dimethoxyphenyl)1(2(methylsulfanyl)1Hbenzimidazol1yl)prop2en1one
(2E)3(34DIMETHOXYPHENYL)1(2METHYLTHIOBENZIMIDAZOLYL)PROP2EN1ONE
(E)3(34DIMETHOXYPHENYL)1(2METHYLSULFANYLBENZIMIDAZOL1YL)PROP2EN1ONE
COC1=C(C=C(C=C1)C=CC(=O)N2C3=CC=CC=C3N=C2SC)OC
COc1cc(C=CC(=O)n2c(SC)nc3c2cccc3)ccc1OC
InChI=1SC19H18N2O3Sc1231610813(1217(16)242)91118(22)2115754614(15)2019(21)253h412H13H3b119+
MFCD03621336
ZINC000004275653
ZINC04275653
ZINC4275653
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