Vitas-M small molecule compound
6-bromo-9-[2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)ethyl]-2,3-dihydro-7H-[1,4]dioxino[2,3-e]indole-8-carboxylic acid
Catalog ID
STK370410
SMILES OC(=O)c1[nH]c2c(c1CCN1C(=O)c3c(C1=O)cccc3)c1OCCOc1cc2Br
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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 C21H15BrN2O6 MW 471.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H15BrN2O6/c22-13-9-14-18(30-8-7-29-14)15-12(16(21(27)28)23-17(13)15)5-6-24-19(25)10-3-1-2-4-11(10)20(24)26/h1-4,9,23H,5-8H2,(H,27,28)InChIKey
NEOBFROCRBQVAV-UHFFFAOYSA-NSynonyms
6bromo9(2(13dioxo13dihydro2Hisoindol2yl)ethyl)23dihydro7H(14)dioxino(23e)indole8carboxylicacid
6BROMO9(2(13DIOXOISOINDOL2YL)ETHYL)37DIHYDRO2H(14)DIOXINO(23E)INDOLE8CARBOXYLICACID
C1COC2=C3C(=C(NC3=C(C=C2O1)Br)C(=O)O)CCN4C(=O)C5=CC=CC=C5C4=O
InChI=1SC21H15BrN2O6c221391418(30872914)1512(16(21(27)28)2317(13)15)562419(25)10312411(10)20(24)26h14923H58H2(H2728)
MFCD00334622
OC(=O)c1(nH)c2c(c1CCN1C(=O)c3c(C1=O)cccc3)c1OCCOc1cc2Br
ZINC000001504853
ZINC1504853
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