Vitas-M small molecule compound
ethyl 2-{[(6-methyl-4-oxo-4H-chromen-2-yl)carbonyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK950351
SMILES CCOC(=O)c1c(NC(=O)c2cc(=O)c3c(o2)ccc(c3)C)sc2c1CCCC2
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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 C22H21NO5S MW 411.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21NO5S/c1-3-27-22(26)19-13-6-4-5-7-18(13)29-21(19)23-20(25)17-11-15(24)14-10-12(2)8-9-16(14)28-17/h8-11H,3-7H2,1-2H3,(H,23,25)InChIKey
YBAOQPKLZLHFDF-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(SC2=C1CCCC2)NC(=O)C3=CC(=O)C4=C(O3)C=CC(=C4)C
ethyl2(((6methyl4oxo4Hchromen2yl)carbonyl)amino)4567tetrahydro1benzothiophene3carboxylate
ethyl2((6methyl4oxochromene2carbonyl)amino)4567tetrahydro1benzothiophene3carboxylate
InChI=1SC22H21NO5Sc132722(26)1913645718(13)2921(19)2320(25)171115(24)141012(2)8916(14)2817h811H37H212H3(H2325)
MFCD07425528
ZINC000006811402
ZINC06811402
ZINC6811402
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