Vitas-M small molecule compound
(2E)-2-(1,3-benzodioxol-5-yl)-3-[3-bromo-4-(dimethylamino)phenyl]prop-2-enenitrile
Catalog ID
STK293066
SMILES N#C/C(=C/c1ccc(c(c1)Br)N(C)C)/c1ccc2c(c1)OCO2
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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 C18H15BrN2O2 MW 371.23 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H15BrN2O2/c1-21(2)16-5-3-12(8-15(16)19)7-14(10-20)13-4-6-17-18(9-13)23-11-22-17/h3-9H,11H2,1-2H3/b14-7-InChIKey
OVRIRSXYWZSYSZ-AUWJEWJLSA-NSynonyms
(2E)2(13BENZODIOXOL5YL)3(3BROMO4(DIMETHYLAMINO)PHENYL)PROP2ENENITRILE
(E)2(13BENZODIOXOL5YL)3(3BROMO4(DIMETHYLAMINO)PHENYL)PROP2ENENITRILE
CN(C)C1=C(C=C(C=C1)C=C(C#N)C2=CC3=C(C=C2)OCO3)Br
InChI=1SC18H15BrN2O2c121(2)165312(815(16)19)714(1020)13461718(913)23112217h39H11H212H3b147
MFCD05824567
N#CC(=Cc1ccc(c(c1)Br)N(C)C)c1ccc2c(c1)OCO2
ZINC000016361602
ZINC16361602
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