Vitas-M small molecule compound
(2E)-3-(4-methoxyphenyl)-1-[2-(prop-2-yn-1-ylsulfanyl)-1H-benzimidazol-1-yl]prop-2-en-1-one
Catalog ID
STK806572
SMILES C#CCSc1nc2c(n1C(=O)/C=C/c1ccc(cc1)OC)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 C20H16N2O2S MW 348.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H16N2O2S/c1-3-14-25-20-21-17-6-4-5-7-18(17)22(20)19(23)13-10-15-8-11-16(24-2)12-9-15/h1,4-13H,14H2,2H3/b13-10+InChIKey
BHWAQFRGZVFGHI-JLHYYAGUSA-NSynonyms
328540-63-2(2E)3(4methoxyphenyl)1(2(prop2yn1ylsulfanyl)1Hbenzimidazol1yl)prop2en1one
(2E)3(4METHOXYPHENYL)1(2PROP2YNYLTHIOBENZIMIDAZOLYL)PROP2EN1ONE
(E)3(4methoxyphenyl)1(2(prop2yn1ylthio)1Hbenzo(d)imidazol1yl)prop2en1one
(E)3(4METHOXYPHENYL)1(2PROP2YNYLSULFANYLBENZIMIDAZOL1YL)PROP2EN1ONE
328540632
C#CCSc1nc2c(n1C(=O)C=Cc1ccc(cc1)OC)cccc2
COC1=CC=C(C=C1)C=CC(=O)N2C3=CC=CC=C3N=C2SCC#C
InChI=1SC20H16N2O2Sc131425202117645718(17)22(20)19(23)13101581116(242)12915h1413H14H22H3b1310+
MFCD01115893
ZINC000003876834
ZINC03876834
ZINC3876834
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