Vitas-M small molecule compound
(2E)-3-(1,3-benzodioxol-5-ylamino)-2-cyano-3-(methylsulfanyl)prop-2-enamide
Catalog ID
STL134866
SMILES CS/C(=C(/C(=O)N)\C#N)/Nc1ccc2c(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 C12H11N3O3S MW 277.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H11N3O3S/c1-19-12(8(5-13)11(14)16)15-7-2-3-9-10(4-7)18-6-17-9/h2-4,15H,6H2,1H3,(H2,14,16)/b12-8+InChIKey
RDBOBQOASRWVLM-XYOKQWHBSA-NSynonyms
1325549-78-7(2E)3(13benzodioxol5ylamino)2cyano3(methylsulfanyl)prop2enamide
(E)3(13benzodioxol5ylamino)2cyano3methylsulfanylprop2enamide
1325549787
CSC(=C(C#N)C(=O)N)NC1=CC2=C(C=C1)OCO2
CSC(=C(C(=O)N)C#N)Nc1ccc2c(c1)OCO2
InChI=1SC12H11N3O3Sc11912(8(513)11(14)16)15723910(47)186179h2415H6H21H3(H21416)b128+
MFCD19705775
ZINC000067172697
ZINC67172697
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