Vitas-M small molecule compound

2-[(2,5-dimethylphenyl)sulfanyl]-1H-isoindole-1,3(2H)-dione

Catalog ID
STK525960
SMILES Cc1ccc(c(c1)SN1C(=O)c2c(C1=O)cccc2)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 C16H13NO2S MW 283.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H13NO2S/c1-10-7-8-11(2)14(9-10)20-17-15(18)12-5-3-4-6-13(12)16(17)19/h3-9H,1-2H3
InChIKey
ASDUIEFWLLMTRL-UHFFFAOYSA-N
Synonyms
77548-43-7
2((25dimethylphenyl)sulfanyl)1Hisoindole13(2H)dione
2((25dimethylphenyl)thio)isoindoline13dione
2(25DIMETHYLPHENYL)SULFANYLISOINDOLE13DIONE
77548437
CC1=CC(=C(C=C1)C)SN2C(=O)C3=CC=CC=C3C2=O
InChI=1SC16H13NO2Sc1107811(2)14(910)201715(18)12534613(12)16(17)19h39H12H3
MFCD01558441
ZINC000000497096
ZINC00497096
ZINC497096

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Available files

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