Vitas-M small molecule compound
methyl 3-[({1-[(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)methyl]-3,4-dihydroisoquinolin-2(1H)-yl}acetyl)amino]-5-methyl-1H-indole-2-carboxylate
Catalog ID
STL344455
SMILES COC(=O)c1[nH]c2c(c1NC(=O)CN1CCc3c(C1CN1C(=O)c4c(C1=O)cccc4)cccc3)cc(cc2)C
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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 C31H28N4O5 MW 536.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H28N4O5/c1-18-11-12-24-23(15-18)27(28(32-24)31(39)40-2)33-26(36)17-34-14-13-19-7-3-4-8-20(19)25(34)16-35-29(37)21-9-5-6-10-22(21)30(35)38/h3-12,15,25,32H,13-14,16-17H2,1-2H3,(H,33,36)InChIKey
MMIPPPZMKFPIPC-UHFFFAOYSA-NSynonyms
395062-69-8395062698
CC1=CC2=C(C=C1)NC(=C2NC(=O)CN3CCC4=CC=CC=C4C3CN5C(=O)C6=CC=CC=C6C5=O)C(=O)OC
COC(=O)c1(nH)c2c(c1NC(=O)CN1CCc3c(C1CN1C(=O)c4c(C1=O)cccc4)cccc3)cc(cc2)C
InChI=1SC31H28N4O5c11811122423(1518)27(28(3224)31(39)402)3326(36)1734141319734820(19)25(34)163529(37)219561022(21)30(35)38h312152532H13141617H212H3(H3336)
methyl3(((1((13dioxo13dihydro2Hisoindol2yl)methyl)34dihydroisoquinolin2(1H)yl)acetyl)amino)5methyl1Hindole2carboxylate
METHYL3((2(1((13DIOXOISOINDOL2YL)METHYL)34DIHYDRO1HISOQUINOLIN2YL)ACETYL)AMINO)5METHYL1HINDOLE2CARBOXYLATE
methyl3(2(1((13dioxoisoindolin2yl)methyl)34dihydroisoquinolin2(1H)yl)acetamido)5methyl1Hindole2carboxylate
MFCD01957813
ZINC000097954510
ZINC000097954511
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.