Vitas-M small molecule compound
ethyl 2-{[(4-bromo-2,6-dimethylphenoxy)acetyl]amino}-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
Catalog ID
STL062947
SMILES CCOC(=O)c1c(NC(=O)COc2c(C)cc(cc2C)Br)sc2c1CCC2
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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 C20H22BrNO4S MW 452.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22BrNO4S/c1-4-25-20(24)17-14-6-5-7-15(14)27-19(17)22-16(23)10-26-18-11(2)8-13(21)9-12(18)3/h8-9H,4-7,10H2,1-3H3,(H,22,23)InChIKey
LPQIHIWKPRYFDC-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(SC2=C1CCC2)NC(=O)COC3=C(C=C(C=C3C)Br)C
ethyl2(((4bromo26dimethylphenoxy)acetyl)amino)56dihydro4Hcyclopenta(b)thiophene3carboxylate
ETHYL2((2(4BROMO26DIMETHYLPHENOXY)ACETYL)AMINO)56DIHYDRO4HCYCLOPENTA(B)THIOPHENE3CARBOXYLATE
InChI=1SC20H22BrNO4Sc142520(24)171465715(14)2719(17)2216(23)10261811(2)813(21)912(18)3h89H4710H213H3(H2223)
MFCD03537313
ZINC000001930421
ZINC01930421
ZINC1930421
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