Vitas-M small molecule compound
methyl 2-[(1,3-benzodioxol-5-ylcarbonyl)amino]-5-(diethylcarbamoyl)-4-methylthiophene-3-carboxylate
Catalog ID
STK427640
SMILES CCN(C(=O)c1sc(c(c1C)C(=O)OC)NC(=O)c1ccc2c(c1)OCO2)CC
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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 C20H22N2O6S MW 418.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22N2O6S/c1-5-22(6-2)19(24)16-11(3)15(20(25)26-4)18(29-16)21-17(23)12-7-8-13-14(9-12)28-10-27-13/h7-9H,5-6,10H2,1-4H3,(H,21,23)InChIKey
SMDVNXUBFCKKAT-UHFFFAOYSA-NSynonyms
CCN(CC)C(=O)C1=C(C(=C(S1)NC(=O)C2=CC3=C(C=C2)OCO3)C(=O)OC)C
InChI=1SC20H22N2O6Sc1522(62)19(24)1611(3)15(20(25)264)18(2916)2117(23)12781314(912)28102713h79H5610H214H3(H2123)
methyl2((13benzodioxol5ylcarbonyl)amino)5(diethylcarbamoyl)4methylthiophene3carboxylate
METHYL2(13BENZODIOXOLE5CARBONYLAMINO)5(DIETHYLCARBAMOYL)4METHYLTHIOPHENE3CARBOXYLATE
METHYL2(2HBENZO(34D)13DIOXOLAN5YLCARBONYLAMINO)5(NNDIETHYLCARBAMOYL)4METHYLTHIOPHENE3CARBOXYLATE
MFCD02733927
ZINC000000871565
ZINC00871565
ZINC871565
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