Vitas-M small molecule compound

ethyl 5-chloro-1-methyl-3-{3-oxo-2-[3-(propan-2-yloxy)propyl]-2,3-dihydro-1H-isoindol-1-yl}-1H-indole-2-carboxylate

Catalog ID
STK129103
SMILES CCOC(=O)c1c(C2N(CCCOC(C)C)C(=O)c3c2cccc3)c2c(n1C)ccc(c2)Cl

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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 C26H29ClN2O4 MW 468.98 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H29ClN2O4/c1-5-32-26(31)24-22(20-15-17(27)11-12-21(20)28(24)4)23-18-9-6-7-10-19(18)25(30)29(23)13-8-14-33-16(2)3/h6-7,9-12,15-16,23H,5,8,13-14H2,1-4H3
InChIKey
NCDXZPRIRSPLIO-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=C(C2=C(N1C)C=CC(=C2)Cl)C3C4=CC=CC=C4C(=O)N3CCCOC(C)C
ETHYL5CHLORO1METHYL3(3OXO2(3(PROPAN2YLOXY)PROPYL)23DIHYDRO1HISOINDOL1YL)1HINDOLE2CARBOXYLATE
ethyl5chloro1methyl3(3oxo2(3propan2yloxypropyl)1Hisoindol1yl)indole2carboxylate
InChI=1SC26H29ClN2O4c153226(31)2422(201517(27)111221(20)28(24)4)23189671019(18)25(30)29(23)138143316(2)3h67912151623H581314H214H3
MFCD08678272
ZINC000009849703
ZINC000009849705

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Available files

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