Vitas-M small molecule compound
(2Z)-2-{4-[(6-chloro-1,3-benzodioxol-5-yl)methoxy]-3-methoxybenzylidene}[1,3]thiazolo[3,2-a]benzimidazol-3(2H)-one
Catalog ID
STK759933
SMILES COc1cc(ccc1OCc1cc2OCOc2cc1Cl)/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 C25H17ClN2O5S MW 492.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H17ClN2O5S/c1-30-20-8-14(9-23-24(29)28-18-5-3-2-4-17(18)27-25(28)34-23)6-7-19(20)31-12-15-10-21-22(11-16(15)26)33-13-32-21/h2-11H,12-13H2,1H3/b23-9-InChIKey
NJROCUHSISMBSI-AQHIEDMUSA-NSynonyms
(2Z)2((4((6CHLORO13BENZODIOXOL5YL)METHOXY)3METHOXYPHENYL)METHYLIDENE)(13)THIAZOLO(32A)BENZIMIDAZOL1ONE
(2Z)2(4((6chloro13benzodioxol5yl)methoxy)3methoxybenzylidene)(13)thiazolo(32a)benzimidazol3(2H)one
2(4((6CHLORO13BENZODIOXOL5YL)METHOXY)3METHOXYBENZYLIDENE)(13)THIAZOLO(32A)BENZIMIDAZOL3(2H)ONE
COC1=C(C=CC(=C1)C=C2C(=O)N3C4=CC=CC=C4N=C3S2)OCC5=CC6=C(C=C5Cl)OCO6
COc1cc(ccc1OCc1cc2OCOc2cc1Cl)C=c1sc2n(c1=O)c1c(n2)cccc1
InChI=1SC25H17ClN2O5Sc13020814(92324(29)2818532417(18)2725(28)3423)6719(20)311215102122(1116(15)26)33133221h211H1213H21H3b239
MFCD01571532
ZINC000008439301
ZINC08439301
ZINC8439301
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