Vitas-M small molecule compound
methyl 2-{[(2E)-2-cyano-3-(3-methylthiophen-2-yl)prop-2-enoyl]amino}-5-(dimethylcarbamoyl)-4-methylthiophene-3-carboxylate
Catalog ID
STK434334
SMILES N#C/C(=C\c1sccc1C)/C(=O)Nc1sc(c(c1C(=O)OC)C)C(=O)N(C)C
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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 C19H19N3O4S2 MW 417.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H19N3O4S2/c1-10-6-7-27-13(10)8-12(9-20)16(23)21-17-14(19(25)26-5)11(2)15(28-17)18(24)22(3)4/h6-8H,1-5H3,(H,21,23)/b12-8+InChIKey
DGAQQSGOMPQNEJ-XYOKQWHBSA-NSynonyms
CC1=C(SC=C1)C=C(C#N)C(=O)NC2=C(C(=C(S2)C(=O)N(C)C)C)C(=O)OC
InChI=1SC19H19N3O4S2c110672713(10)812(920)16(23)211714(19(25)265)11(2)15(2817)18(24)22(3)4h68H15H3(H2123)b128+
methyl2(((2E)2cyano3(3methylthiophen2yl)prop2enoyl)amino)5(dimethylcarbamoyl)4methylthiophene3carboxylate
METHYL2(((E)2CYANO3(3METHYLTHIOPHEN2YL)PROP2ENOYL)AMINO)5(DIMETHYLCARBAMOYL)4METHYLTHIOPHENE3CARBOXYLATE
METHYL2((2E)2CYANO3(3METHYL(2THIENYL))PROP2ENOYLAMINO)5(NNDIMETHYLCARBAMOYL)4METHYLTHIOPHENE3CARBOXYLATE
MFCD03942809
N#CC(=Cc1sccc1C)C(=O)Nc1sc(c(c1C(=O)OC)C)C(=O)N(C)C
ZINC000017091106
ZINC17091106
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.