Vitas-M small molecule compound
4-{[3-(ethoxycarbonyl)-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]amino}-4-oxobutanoic acid
Catalog ID
STK996418
SMILES CCOC(=O)c1c(NC(=O)CCC(=O)O)sc2c1CCC(C2)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 C16H21NO5S MW 339.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H21NO5S/c1-3-22-16(21)14-10-5-4-9(2)8-11(10)23-15(14)17-12(18)6-7-13(19)20/h9H,3-8H2,1-2H3,(H,17,18)(H,19,20)InChIKey
YQBOXYLARGFHPN-UHFFFAOYSA-NSynonyms
440091-50-94((3(ethoxycarbonyl)6methyl4567tetrahydro1benzothiophen2yl)amino)4oxobutanoicacid
4((3ethoxycarbonyl6methyl4567tetrahydro1benzothiophen2yl)amino)4oxobutanoicacid
440091509
CCOC(=O)C1=C(SC2=C1CCC(C2)C)NC(=O)CCC(=O)O
InChI=1SC16H21NO5Sc132216(21)1410549(2)811(10)2315(14)1712(18)6713(19)20h9H38H212H3(H1718)(H1920)
MFCD02631198
ZINC000000356520
ZINC000000356523
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