Vitas-M small molecule compound
ethyl 4-(2,5-dioxo-3-{[2-oxo-2-(phenylamino)ethyl]sulfanyl}pyrrolidin-1-yl)benzoate
Catalog ID
STL000137
SMILES CCOC(=O)c1ccc(cc1)N1C(=O)CC(C1=O)SCC(=O)Nc1ccccc1
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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 C21H20N2O5S MW 412.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20N2O5S/c1-2-28-21(27)14-8-10-16(11-9-14)23-19(25)12-17(20(23)26)29-13-18(24)22-15-6-4-3-5-7-15/h3-11,17H,2,12-13H2,1H3,(H,22,24)InChIKey
JQYMWPBSWICARG-UHFFFAOYSA-NSynonyms
496040-75-6496040756
CCOC(=O)C1=CC=C(C=C1)N2C(=O)CC(C2=O)SCC(=O)NC3=CC=CC=C3
ETHYL4((3R)25DIOXO3((2OXO2(PHENYLAMINO)ETHYL)SULFANYL)PYRROLIDIN1YL)BENZOATE
ethyl4(25dioxo3((2oxo2(phenylamino)ethyl)sulfanyl)pyrrolidin1yl)benzoate
ethyl4(25dioxo3((2oxo2(phenylamino)ethyl)thio)pyrrolidin1yl)benzoate
ETHYL4(3(2ANILINO2OXOETHYL)SULFANYL25DIOXOPYRROLIDIN1YL)BENZOATE
InChI=1SC21H20N2O5Sc122821(27)1481016(11914)2319(25)1217(20(23)26)291318(24)22156435715h31117H21213H21H3(H2224)
MFCD03506070
ZINC000001126665
ZINC000100819825
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