Vitas-M small molecule compound

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

Catalog ID
STL290969
SMILES Cc1cccc(c1)C(=O)OCCN(C1=NS(=O)(=O)c2c1cccc2)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 C18H18N2O4S MW 358.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18N2O4S/c1-13-6-5-7-14(12-13)18(21)24-11-10-20(2)17-15-8-3-4-9-16(15)25(22,23)19-17/h3-9,12H,10-11H2,1-2H3
InChIKey
JJMJNVFAPFJKKJ-UHFFFAOYSA-N
Synonyms

2((11dioxido12benzothiazol3yl)(methyl)amino)ethyl3methylbenzoate
2((11DIOXO12BENZOTHIAZOL3YL)METHYLAMINO)ETHYL3METHYLBENZOATE
CC1=CC=CC(=C1)C(=O)OCCN(C)C2=NS(=O)(=O)C3=CC=CC=C32
InChI=1SC18H18N2O4Sc11365714(1213)18(21)24111020(2)1715834916(15)25(2223)1917h3912H1011H212H3
MFCD00763409
ZINC000001461785
ZINC1461785

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Available files

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