Vitas-M small molecule compound
propan-2-yl 4,5-dimethyl-2-{[(2E)-3-(5-methylfuran-2-yl)prop-2-enoyl]amino}thiophene-3-carboxylate
Catalog ID
STK439367
SMILES CC(OC(=O)c1c(NC(=O)/C=C/c2ccc(o2)C)sc(c1C)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 C18H21NO4S MW 347.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H21NO4S/c1-10(2)22-18(21)16-12(4)13(5)24-17(16)19-15(20)9-8-14-7-6-11(3)23-14/h6-10H,1-5H3,(H,19,20)/b9-8+InChIKey
JJNNCBJYWSPDGU-CMDGGOBGSA-NSynonyms
45DIMETHYL2(((E)3(5METHYL2FURANYL)1OXOPROP2ENYL)AMINO)3THIOPHENECARBOXYLICACIDPROPAN2YLESTER
45DIMETHYL2(((E)3(5METHYL2FURYL)ACRYLOYL)AMINO)THIOPHENE3CARBOXYLICACIDISOPROPYLESTER
CC(OC(=O)c1c(NC(=O)C=Cc2ccc(o2)C)sc(c1C)C)C
CC1=CC=C(O1)C=CC(=O)NC2=C(C(=C(S2)C)C)C(=O)OC(C)C
InChI=1SC18H21NO4Sc110(2)2218(21)1612(4)13(5)2417(16)1915(20)98147611(3)2314h610H15H3(H1920)b98+
ISOPROPYL45DIMETHYL2((3(5METHYL2FURYL)ACRYLOYL)AMINO)3THIOPHENECARBOXYLATE
METHYLETHYL2((2E)3(5METHYL(2FURYL))PROP2ENOYLAMINO)45DIMETHYLTHIOPHENE3CARBOXYLATE
MFCD01350214
propan2yl45dimethyl2(((2E)3(5methylfuran2yl)prop2enoyl)amino)thiophene3carboxylate
PROPAN2YL45DIMETHYL2(((E)3(5METHYLFURAN2YL)PROP2ENOYL)AMINO)THIOPHENE3CARBOXYLATE
ZINC000000474110
ZINC00474110
ZINC474110
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Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.