Vitas-M small molecule compound
5-benzyl-3-(5-chloro-2-hydroxyphenyl)-1-methyl-4,6-dioxooctahydropyrrolo[3,4-c]pyrrole-1-carboxylic acid
Catalog ID
STK679458
SMILES Clc1ccc(c(c1)C1NC(C2C1C(=O)N(C2=O)Cc1ccccc1)(C)C(=O)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 C21H19ClN2O5 MW 414.85 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19ClN2O5/c1-21(20(28)29)16-15(17(23-21)13-9-12(22)7-8-14(13)25)18(26)24(19(16)27)10-11-5-3-2-4-6-11/h2-9,15-17,23,25H,10H2,1H3,(H,28,29)InChIKey
OLRUNIKMULYONL-UHFFFAOYSA-NSynonyms
5BENZYL1(5CHLORO2HYDROXYPHENYL)3METHYL46DIOXO123A6ATETRAHYDROPYRROLO(34C)PYRROLE3CARBOXYLICACID
5benzyl3(5chloro2hydroxyphenyl)1methyl46dioxooctahydropyrrolo(34c)pyrrole1carboxylicacid
CC1(C2C(C(N1)C3=C(C=CC(=C3)Cl)O)C(=O)N(C2=O)CC4=CC=CC=C4)C(=O)O
InChI=1SC21H19ClN2O5c121(20(28)29)1615(17(2321)13912(22)7814(13)25)18(26)24(19(16)27)10115324611h2915172325H10H21H3(H2829)
MFCD03763561
ZINC000015276290
ZINC000245256311
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