Vitas-M small molecule compound

2-[(1,1-dioxido-1,2-benzothiazol-3-yl)amino]-2-methylpropyl 3-methylbenzoate

Catalog ID
STL290948
SMILES Cc1cccc(c1)C(=O)OCC(NC1=NS(=O)(=O)c2c1cccc2)(C)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 C19H20N2O4S MW 372.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H20N2O4S/c1-13-7-6-8-14(11-13)18(22)25-12-19(2,3)20-17-15-9-4-5-10-16(15)26(23,24)21-17/h4-11H,12H2,1-3H3,(H,20,21)
InChIKey
DIUXBRIPIJQNAR-UHFFFAOYSA-N
Synonyms

(2((11DIOXO12BENZOTHIAZOL3YL)AMINO)2METHYLPROPYL)3METHYLBENZOATE
2((11dioxido12benzothiazol3yl)amino)2methylpropyl3methylbenzoate
CC1=CC=CC(=C1)C(=O)OCC(C)(C)NC2=NS(=O)(=O)C3=CC=CC=C32
InChI=1SC19H20N2O4Sc11376814(1113)18(22)251219(23)2017159451016(15)26(2324)2117h411H12H213H3(H2021)
MFCD00825363
ZINC000001461775
ZINC01461775
ZINC1461775

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Available files

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