Vitas-M small molecule compound
4-butyl 2-ethyl 3-methyl-5-[(3-oxo-1,3-dihydro-2-benzofuran-1-yl)amino]thiophene-2,4-dicarboxylate
Catalog ID
STK898066
SMILES CCCCOC(=O)c1c(sc(c1C)C(=O)OCC)NC1OC(=O)c2c1cccc2
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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 C21H23NO6S MW 417.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23NO6S/c1-4-6-11-27-20(24)15-12(3)16(21(25)26-5-2)29-18(15)22-17-13-9-7-8-10-14(13)19(23)28-17/h7-10,17,22H,4-6,11H2,1-3H3InChIKey
CANZSYYJCPZOFA-UHFFFAOYSA-NSynonyms
4butyl2ethyl3methyl5((3oxo13dihydro2benzofuran1yl)amino)thiophene24dicarboxylate
4Obutyl2Oethyl3methyl5((3oxo1H2benzofuran1yl)amino)thiophene24dicarboxylate
CCCCOC(=O)C1=C(SC(=C1C)C(=O)OCC)NC2C3=CC=CC=C3C(=O)O2
InChI=1SC21H23NO6Sc146112720(24)1512(3)16(21(25)2652)2918(15)2217139781014(13)19(23)2817h7101722H4611H213H3
MFCD18172818
ZINC000044827148
ZINC000044827151
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