Vitas-M small molecule compound
(2E)-2-(1,3-benzothiazol-2-yl)-3-(6-bromo-1,3-benzodioxol-5-yl)prop-2-enenitrile
Catalog ID
STK854350
SMILES N#C/C(=C\c1cc2OCOc2cc1Br)/c1nc2c(s1)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 C17H9BrN2O2S MW 385.24 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H9BrN2O2S/c18-12-7-15-14(21-9-22-15)6-10(12)5-11(8-19)17-20-13-3-1-2-4-16(13)23-17/h1-7H,9H2/b11-5+InChIKey
XFWSNCDPIPJQMK-VZUCSPMQSA-NSynonyms
326904-11-4(2E)2(13benzothiazol2yl)3(6bromo13benzodioxol5yl)prop2enenitrile
(2E)2BENZOTHIAZOL2YL3(6BROMO(2HBENZO(D)13DIOXOLAN5YL))PROP2ENENITRILE
(E)2(13BENZOTHIAZOL2YL)3(6BROMO13BENZODIOXOL5YL)PROP2ENENITRILE
(E)2(benzo(d)thiazol2yl)3(6bromobenzo(d)(13)dioxol5yl)acrylonitrile
2BENZOTHIAZOL2YL3(6BROMOBENZO(13)DIOXOL5YL)ACRYLONITRILE
326904114
C1OC2=C(O1)C=C(C(=C2)C=C(C#N)C3=NC4=CC=CC=C4S3)Br
InChI=1SC17H9BrN2O2Sc181271514(2192215)610(12)511(819)172013312416(13)2317h17H9H2b115+
MFCD01839242
N#CC(=Cc1cc2OCOc2cc1Br)c1nc2c(s1)cccc2
ZINC000004867029
ZINC04867029
ZINC4867029
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