Vitas-M small molecule compound
[(2-{[4-(difluoromethoxy)-2-methylphenyl]amino}-2-oxoethyl)sulfanyl]acetic acid
Catalog ID
STK467050
SMILES O=C(Nc1ccc(cc1C)OC(F)F)CSCC(=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 C12H13F2NO4S MW 305.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H13F2NO4S/c1-7-4-8(19-12(13)14)2-3-9(7)15-10(16)5-20-6-11(17)18/h2-4,12H,5-6H2,1H3,(H,15,16)(H,17,18)InChIKey
LUPVKSAGUDXMLF-UHFFFAOYSA-NSynonyms
((2((4(difluoromethoxy)2methylphenyl)amino)2oxoethyl)sulfanyl)aceticacid
2((N(4(DIFLUOROMETHOXY)2METHYLPHENYL)CARBAMOYL)METHYLTHIO)ACETICACID
2(2(4(difluoromethoxy)2methylanilino)2oxoethyl)sulfanylaceticacid
CC1=C(C=CC(=C1)OC(F)F)NC(=O)CSCC(=O)O
InChI=1SC12H13F2NO4Sc1748(1912(13)14)239(7)1510(16)520611(17)18h2412H56H21H3(H1516)(H1718)
MFCD06062830
ZINC000017031161
ZINC17031161
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