Vitas-M small molecule compound
2-oxo-2-(thiophen-2-yl)ethyl 6-bromo-2-[4-(4-methyl-1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-isoindol-2-yl)phenyl]quinoline-4-carboxylate
Catalog ID
STK286869
SMILES Brc1ccc2c(c1)c(cc(n2)c1ccc(cc1)N1C(=O)C2C(C1=O)C(C)C=CC2)C(=O)OCC(=O)c1cccs1
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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 C31H23BrN2O5S MW 615.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H23BrN2O5S/c1-17-4-2-5-21-28(17)30(37)34(29(21)36)20-10-7-18(8-11-20)25-15-23(22-14-19(32)9-12-24(22)33-25)31(38)39-16-26(35)27-6-3-13-40-27/h2-4,6-15,17,21,28H,5,16H2,1H3InChIKey
IHKHYHVVZDUXBX-UHFFFAOYSA-NSynonyms
(2OXO2THIOPHEN2YLETHYL)6BROMO2(4(4METHYL13DIOXO3A477ATETRAHYDROISOINDOL2YL)PHENYL)QUINOLINE4CARBOXYLATE
2oxo2(thiophen2yl)ethyl6bromo2(4(4methyl13dioxo133a477ahexahydro2Hisoindol2yl)phenyl)quinoline4carboxylate
CC1C=CCC2C1C(=O)N(C2=O)C3=CC=C(C=C3)C4=NC5=C(C=C(C=C5)Br)C(=C4)C(=O)OCC(=O)C6=CC=CS6
InChI=1SC31H23BrN2O5Sc1174252128(17)30(37)34(29(21)36)2010718(81120)251523(221419(32)91224(22)3325)31(38)391626(35)2763134027h24615172128H516H21H3
MFCD03649026
ZINC000100395676
ZINC000239310284
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