Vitas-M small molecule compound
2-({2-methoxy-4-[(Z)-(3-oxo[1,3]thiazolo[3,2-a]benzimidazol-2(3H)-ylidene)methyl]-6-(prop-2-en-1-yl)phenoxy}methyl)benzonitrile
Catalog ID
STK073427
SMILES C=CCc1cc(cc(c1OCc1ccccc1C#N)OC)/C=c/1\sc2n(c1=O)c1c(n2)cccc1
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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 C28H21N3O3S MW 479.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H21N3O3S/c1-3-8-19-13-18(14-24(33-2)26(19)34-17-21-10-5-4-9-20(21)16-29)15-25-27(32)31-23-12-7-6-11-22(23)30-28(31)35-25/h3-7,9-15H,1,8,17H2,2H3/b25-15-InChIKey
HODBDXUTMUBPOA-MYYYXRDXSA-NSynonyms
2((2METHOXY4((Z)(1OXO(13)THIAZOLO(32A)BENZIMIDAZOL2YLIDENE)METHYL)6PROP2ENYLPHENOXY)METHYL)BENZONITRILE
2((2METHOXY4((Z)(3OXO(13)THIAZOLO(32A)BENZIMIDAZOL2(3H)YLIDENE)METHYL)6(PROP2EN1YL)PHENOXY)METHYL)BENZONITRILE
C=CCc1cc(cc(c1OCc1ccccc1C#N)OC)C=c1sc2n(c1=O)c1c(n2)cccc1
COC1=CC(=CC(=C1OCC2=CC=CC=C2C#N)CC=C)C=C3C(=O)N4C5=CC=CC=C5N=C4S3
InChI=1SC28H21N3O3Sc138191318(1424(332)26(19)3417211054920(21)1629)152527(32)312312761122(23)3028(31)3525h37915H1817H22H3b2515
MFCD03247974
STK073427
ZINC000009260460
ZINC09260460
ZINC9260460
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