Vitas-M small molecule compound

5-(1,3-benzothiazol-2-yl)-2-(3-methylbutyl)-1H-isoindole-1,3(2H)-dione

Catalog ID
STK271404
SMILES CC(CCN1C(=O)c2c(C1=O)cc(cc2)c1nc2c(s1)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 C20H18N2O2S MW 350.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18N2O2S/c1-12(2)9-10-22-19(23)14-8-7-13(11-15(14)20(22)24)18-21-16-5-3-4-6-17(16)25-18/h3-8,11-12H,9-10H2,1-2H3
InChIKey
NOTBGPPHISGIIX-UHFFFAOYSA-N
Synonyms

5(13benzothiazol2yl)2(3methylbutyl)1Hisoindole13(2H)dione
5(13BENZOTHIAZOL2YL)2(3METHYLBUTYL)ISOINDOLE13DIONE
5(13BENZOTHIAZOL2YL)2ISOPENTYL1HISOINDOLE13(2H)DIONE
CC(C)CCN1C(=O)C2=C(C1=O)C=C(C=C2)C3=NC4=CC=CC=C4S3
InChI=1SC20H18N2O2Sc112(2)9102219(23)148713(1115(14)20(22)24)182116534617(16)2518h381112H910H212H3
MFCD03865077
ZINC000000692870
ZINC00692870
ZINC692870

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Available files

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