Vitas-M small molecule compound
5-ethyl-3-(2-hydroxyphenyl)-1-[2-(methylsulfanyl)ethyl]-4,6-dioxooctahydropyrrolo[3,4-c]pyrrole-1-carboxylic acid
Catalog ID
STK676501
SMILES CSCCC1(NC(C2C1C(=O)N(C2=O)CC)c1ccccc1O)C(=O)O
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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 C18H22N2O5S MW 378.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H22N2O5S/c1-3-20-15(22)12-13(16(20)23)18(17(24)25,8-9-26-2)19-14(12)10-6-4-5-7-11(10)21/h4-7,12-14,19,21H,3,8-9H2,1-2H3,(H,24,25)InChIKey
GPLDLWKDASQXAC-UHFFFAOYSA-NSynonyms
5ETHYL1(2HYDROXYPHENYL)3(2METHYLSULFANYLETHYL)46DIOXO123A6ATETRAHYDROPYRROLO(34C)PYRROLE3CARBOXYLICACID
5ethyl3(2hydroxyphenyl)1(2(methylsulfanyl)ethyl)46dioxooctahydropyrrolo(34c)pyrrole1carboxylicacid
CCN1C(=O)C2C(C1=O)C(NC2C3=CC=CC=C3O)(CCSC)C(=O)O
InChI=1SC18H22N2O5Sc132015(22)1213(16(20)23)18(17(24)2589262)1914(12)10645711(10)21h4712141921H389H212H3(H2425)
MFCD02019173
ZINC000022027831
ZINC000229989773
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