Vitas-M small molecule compound
3-(5-bromo-2-hydroxyphenyl)-5-(3-chlorophenyl)-1-methyl-4,6-dioxooctahydropyrrolo[3,4-c]pyrrole-1-carboxylic acid
Catalog ID
STK679077
SMILES Clc1cccc(c1)N1C(=O)C2C(C1=O)C(NC2c1cc(Br)ccc1O)(C)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 C20H16BrClN2O5 MW 479.71 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H16BrClN2O5/c1-20(19(28)29)15-14(16(23-20)12-7-9(21)5-6-13(12)25)17(26)24(18(15)27)11-4-2-3-10(22)8-11/h2-8,14-16,23,25H,1H3,(H,28,29)InChIKey
KDZAPOPKRQNTCS-UHFFFAOYSA-NSynonyms
1(5BROMO2HYDROXYPHENYL)5(3CHLOROPHENYL)3METHYL46DIOXO123A6ATETRAHYDROPYRROLO(34C)PYRROL2IUM3CARBOXYLATE
1(5BROMO2HYDROXYPHENYL)5(3CHLOROPHENYL)3METHYL46DIOXO123A6ATETRAHYDROPYRROLO(34C)PYRROLE3CARBOXYLICACID
3(5bromo2hydroxyphenyl)5(3chlorophenyl)1methyl46dioxooctahydropyrrolo(34c)pyrrole1carboxylicacid
CC1(C2C(C((NH2+)1)C3=C(C=CC(=C3)Br)O)C(=O)N(C2=O)C4=CC(=CC=C4)Cl)C(=O)(O)
InChI=1SC20H16BrClN2O5c120(19(28)29)1514(16(2320)1279(21)5613(12)25)17(26)24(18(15)27)1142310(22)811h2814162325H1H3(H2829)
MFCD03408310
ZINC000015276073
ZINC000103000872
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