Vitas-M small molecule compound
ethyl 3-[({1-[(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)methyl]-3,4-dihydroisoquinolin-2(1H)-yl}acetyl)amino]-5-fluoro-1H-indole-2-carboxylate
Catalog ID
STL055990
SMILES CCOC(=O)c1[nH]c2c(c1NC(=O)CN1CCc3c(C1CN1C(=O)c4c(C1=O)cccc4)cccc3)cc(cc2)F
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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 C31H27FN4O5 MW 554.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H27FN4O5/c1-2-41-31(40)28-27(23-15-19(32)11-12-24(23)33-28)34-26(37)17-35-14-13-18-7-3-4-8-20(18)25(35)16-36-29(38)21-9-5-6-10-22(21)30(36)39/h3-12,15,25,33H,2,13-14,16-17H2,1H3,(H,34,37)InChIKey
UPRTXZCKYPCEIR-UHFFFAOYSA-NSynonyms
CCOC(=O)c1(nH)c2c(c1NC(=O)CN1CCc3c(C1CN1C(=O)c4c(C1=O)cccc4)cccc3)cc(cc2)F
CCOC(=O)C1=C(C2=C(N1)C=CC(=C2)F)NC(=O)CN3CCC4=CC=CC=C4C3CN5C(=O)C6=CC=CC=C6C5=O
ethyl3(((1((13dioxo13dihydro2Hisoindol2yl)methyl)34dihydroisoquinolin2(1H)yl)acetyl)amino)5fluoro1Hindole2carboxylate
ETHYL3((2(1((13DIOXOISOINDOL2YL)METHYL)34DIHYDRO1HISOQUINOLIN2YL)ACETYL)AMINO)5FLUORO1HINDOLE2CARBOXYLATE
ethyl3(2(1((13dioxoisoindolin2yl)methyl)34dihydroisoquinolin2(1H)yl)acetamido)5fluoro1Hindole2carboxylate
InChI=1SC31H27FN4O5c124131(40)2827(231519(32)111224(23)3328)3426(37)1735141318734820(18)25(35)163629(38)219561022(21)30(36)39h312152533H213141617H21H3(H3437)
MFCD02239341
ZINC000001292345
ZINC000001292347
Check stock
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