Vitas-M small molecule compound

3-hexadecyl-1-[3-oxo-2-(quinolin-8-ylsulfanyl)-2,3-dihydro-1H-inden-5-yl]pyrrolidine-2,5-dione

Catalog ID
STK368838
SMILES CCCCCCCCCCCCCCCCC1CC(=O)N(C1=O)c1ccc2c(c1)C(=O)C(C2)Sc1cccc2c1nccc2

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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 C38H48N2O3S MW 612.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C38H48N2O3S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18-30-26-35(41)40(38(30)43)31-23-22-29-25-34(37(42)32(29)27-31)44-33-21-16-19-28-20-17-24-39-36(28)33/h16-17,19-24,27,30,34H,2-15,18,25-26H2,1H3
InChIKey
LLBLXBWTJPYQCX-UHFFFAOYSA-N
Synonyms

3HEXADECYL1(3OXO2(8QUINOLYLTHIO)INDAN5YL)AZOLIDINE25DIONE
3hexadecyl1(3oxo2(quinolin8ylsulfanyl)23dihydro1Hinden5yl)pyrrolidine25dione
3HEXADECYL1(3OXO2QUINOLIN8YLSULFANYL12DIHYDROINDEN5YL)PYRROLIDINE25DIONE
CCCCCCCCCCCCCCCCC1CC(=O)N(C1=O)C2=CC3=C(CC(C3=O)SC4=CC=CC5=C4N=CC=C5)C=C2
InChI=1SC38H48N2O3Sc12345678910111213141518302635(41)40(38(30)43)312322292534(37(42)32(29)2731)4433211619282017243936(28)33h16171924273034H215182526H21H3
MFCD00311425
ZINC000102057603
ZINC000102057617

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.