Vitas-M small molecule compound
(2E)-N-(1,3-benzodioxol-5-ylmethyl)-3-(5-bromothiophen-2-yl)-2-cyanoprop-2-enamide
Catalog ID
STK443932
SMILES N#C/C(=C\c1ccc(s1)Br)/C(=O)NCc1ccc2c(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 C16H11BrN2O3S MW 391.25 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H11BrN2O3S/c17-15-4-2-12(23-15)6-11(7-18)16(20)19-8-10-1-3-13-14(5-10)22-9-21-13/h1-6H,8-9H2,(H,19,20)/b11-6+InChIKey
JRDUAHKFLNKIOV-IZZDOVSWSA-NSynonyms
(2E)N(13benzodioxol5ylmethyl)3(5bromothiophen2yl)2cyanoprop2enamide
(2E)N(2HBENZO(34D)13DIOXOLAN5YLMETHYL)3(5BROMO(2THIENYL))2CYANOPROP2ENAMIDE
(E)N(13benzodioxol5ylmethyl)3(5bromothiophen2yl)2cyanoprop2enamide
C1OC2=C(O1)C=C(C=C2)CNC(=O)C(=CC3=CC=C(S3)Br)C#N
InChI=1SC16H11BrN2O3Sc17154212(2315)611(718)16(20)19810131314(510)2292113h16H89H2(H1920)b116+
MFCD04055127
N#CC(=Cc1ccc(s1)Br)C(=O)NCc1ccc2c(c1)OCO2
ZINC000006829247
ZINC06829247
ZINC6829247
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