Vitas-M small molecule compound
2-(4-bromophenyl)-2-oxoethyl 2-[4-(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl)phenyl]-6-methylquinoline-4-carboxylate
Catalog ID
STK286873
SMILES Cc1ccc2c(c1)c(cc(n2)c1ccc(cc1)N1C(=O)C2C(C1=O)C1CC2C=C1)C(=O)OCC(=O)c1ccc(cc1)Br
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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 C34H25BrN2O5 MW 621.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H25BrN2O5/c1-18-2-13-27-25(14-18)26(34(41)42-17-29(38)20-5-9-23(35)10-6-20)16-28(36-27)19-7-11-24(12-8-19)37-32(39)30-21-3-4-22(15-21)31(30)33(37)40/h2-14,16,21-22,30-31H,15,17H2,1H3InChIKey
QPZPDMASXAJWQG-UHFFFAOYSA-NSynonyms
2(4bromophenyl)2oxoethyl2(4(13dioxo133a477ahexahydro2H47methanoisoindol2yl)phenyl)6methylquinoline4carboxylate
CC1=CC2=C(C=C1)N=C(C=C2C(=O)OCC(=O)C3=CC=C(C=C3)Br)C4=CC=C(C=C4)N5C(=O)C6C7CC(C6C5=O)C=C7
InChI=1SC34H25BrN2O5c1182132725(1418)26(34(41)421729(38)205923(35)10620)1628(3627)1971124(12819)3732(39)30213422(1521)31(30)33(37)40h2141621223031H1517H21H3
MFCD03649032
ZINC000100395695
ZINC000101464991
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