Vitas-M small molecule compound
2,2'-[sulfanediylbis(benzene-4,1-diylsulfanediylbenzene-4,1-diyl)]bis(3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-dione)
Catalog ID
STK089580
SMILES O=C1C2C3C=CC(C2C(=O)N1c1ccc(cc1)Sc1ccc(cc1)Sc1ccc(cc1)Sc1ccc(cc1)N1C(=O)C2C(C1=O)C1CC2C=C1)C3
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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 C42H32N2O4S3 MW 724.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C42H32N2O4S3/c45-39-35-23-1-2-24(21-23)36(35)40(46)43(39)27-5-9-29(10-6-27)49-31-13-17-33(18-14-31)51-34-19-15-32(16-20-34)50-30-11-7-28(8-12-30)44-41(47)37-25-3-4-26(22-25)38(37)42(44)48/h1-20,23-26,35-38H,21-22H2InChIKey
XFUYQOSCKGCWEC-UHFFFAOYSA-NSynonyms
22(SULFANEDIYLBIS(BENZENE41DIYLSULFANEDIYLBENZENE41DIYL))BIS(3A477ATETRAHYDRO1H47METHANOISOINDOLE13(2H)DIONE)
C1C2C=CC1C3C2C(=O)N(C3=O)C4=CC=C(C=C4)SC5=CC=C(C=C5)SC6=CC=C(C=C6)SC7=CC=C(C=C7)N8C(=O)C9C1CC(C9C8=O)C=C1
InChI=1SC42H32N2O4S3c453935231224(2123)36(35)40(46)43(39)275929(10627)4931131733(181431)5134191532(162034)503011728(81230)4441(47)37253426(2225)38(37)42(44)48h12023263538H2122H2
MFCD00304607
O=C1C2C3C=CC(C2C(=O)N1c1ccc(cc1)Sc1ccc(cc1)Sc1ccc(cc1)Sc1ccc(cc1)N1C(=O)C2C(C1=O)C1CC2C=C1)C3
STK089580
ZINC000150351706
ZINC000245228008
Check stock
See real-time availability and sample size for STK089580 on the Vitas-M platform.
Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.