Vitas-M small molecule compound
(2E)-3-(1,3-benzodioxol-5-yl)-1-[2-(prop-2-en-1-ylsulfanyl)-1H-benzimidazol-1-yl]prop-2-en-1-one
Catalog ID
STK806847
SMILES C=CCSc1nc2c(n1C(=O)/C=C/c1ccc3c(c1)OCO3)cccc2
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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 C20H16N2O3S MW 364.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H16N2O3S/c1-2-11-26-20-21-15-5-3-4-6-16(15)22(20)19(23)10-8-14-7-9-17-18(12-14)25-13-24-17/h2-10,12H,1,11,13H2/b10-8+InChIKey
KVBDZFJFAJJYFK-CSKARUKUSA-NSynonyms
326907-80-6(2E)3(13benzodioxol5yl)1(2(prop2en1ylsulfanyl)1Hbenzimidazol1yl)prop2en1one
(2E)3(2HBENZO(34D)13DIOXOLEN5YL)1(2PROP2ENYLTHIOBENZIMIDAZOLYL)PROP2EN1ONE
(E)1(2(allylthio)1Hbenzo(d)imidazol1yl)3(benzo(d)(13)dioxol5yl)prop2en1one
(E)3(13BENZODIOXOL5YL)1(2PROP2ENYLSULFANYLBENZIMIDAZOL1YL)PROP2EN1ONE
326907806
C=CCSC1=NC2=CC=CC=C2N1C(=O)C=CC3=CC4=C(C=C3)OCO4
C=CCSc1nc2c(n1C(=O)C=Cc1ccc3c(c1)OCO3)cccc2
InChI=1SC20H16N2O3Sc121126202115534616(15)22(20)19(23)10814791718(1214)25132417h21012H11113H2b108+
MFCD02658814
ZINC000004094893
ZINC04094893
ZINC4094893
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