Vitas-M small molecule compound

N-[2-(cyclohex-1-en-1-yl)ethyl]-3-methyl-4-propyl-4H-1,2,4-benzothiadiazine-7-carboxamide 1,1-dioxide

Catalog ID
STL420968
SMILES CCCN1C(=NS(=O)(=O)c2c1ccc(c2)C(=O)NCCC1=CCCCC1)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 C20H27N3O3S MW 389.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H27N3O3S/c1-3-13-23-15(2)22-27(25,26)19-14-17(9-10-18(19)23)20(24)21-12-11-16-7-5-4-6-8-16/h7,9-10,14H,3-6,8,11-13H2,1-2H3,(H,21,24)
InChIKey
QBQBXINOTOVKPP-UHFFFAOYSA-N
Synonyms

CCCN1C(=NS(=O)(=O)C2=C1C=CC(=C2)C(=O)NCCC3=CCCCC3)C
InChI=1SC20H27N3O3Sc13132315(2)2227(2526)191417(91018(19)23)20(24)211211167546816h791014H3681113H212H3(H2124)
MFCD15079453
N(2(cyclohex1en1yl)ethyl)3methyl4propyl4H124benzothiadiazine7carboxamide11dioxide
N(2(cyclohexen1yl)ethyl)3methyl11dioxo4propyl1$l^(6)24benzothiadiazine7carboxamide
ZINC000015867548
ZINC15867548

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Available files

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