Vitas-M small molecule compound
propan-2-yl 4-ethyl-2-{[(2E)-3-(4-fluorophenyl)prop-2-enoyl]amino}-5-methylthiophene-3-carboxylate
Catalog ID
STK433519
SMILES CCc1c(C)sc(c1C(=O)OC(C)C)NC(=O)/C=C/c1ccc(cc1)F
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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 C20H22FNO3S MW 375.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22FNO3S/c1-5-16-13(4)26-19(18(16)20(24)25-12(2)3)22-17(23)11-8-14-6-9-15(21)10-7-14/h6-12H,5H2,1-4H3,(H,22,23)/b11-8+InChIKey
XJWBIUBCHLRGDI-DHZHZOJOSA-NSynonyms
CCC1=C(SC(=C1C(=O)OC(C)C)NC(=O)C=CC2=CC=C(C=C2)F)C
CCc1c(C)sc(c1C(=O)OC(C)C)NC(=O)C=Cc1ccc(cc1)F
InChI=1SC20H22FNO3Sc151613(4)2619(18(16)20(24)2512(2)3)2217(23)118146915(21)10714h612H5H214H3(H2223)b118+
ISOPROPYL4ETHYL2((3(4FLUOROPHENYL)ACRYLOYL)AMINO)5METHYL3THIOPHENECARBOXYLATE
METHYLETHYL2((2E)3(4FLUOROPHENYL)PROP2ENOYLAMINO)4ETHYL5METHYLTHIOPHENE3CARBOXYLATE
MFCD03365044
propan2yl4ethyl2(((2E)3(4fluorophenyl)prop2enoyl)amino)5methylthiophene3carboxylate
PROPAN2YL4ETHYL2(((E)3(4FLUOROPHENYL)PROP2ENOYL)AMINO)5METHYLTHIOPHENE3CARBOXYLATE
ZINC000002085373
ZINC02085373
ZINC2085373
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Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.