Vitas-M small molecule compound
methyl 3-[1,1-dioxido-2-(piperidin-1-ylcarbonyl)-4H-1,4-benzothiazin-4-yl]benzoate
Catalog ID
STL097110
SMILES COC(=O)c1cccc(c1)N1C=C(C(=O)N2CCCCC2)S(=O)(=O)c2c1cccc2
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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 C22H22N2O5S MW 426.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22N2O5S/c1-29-22(26)16-8-7-9-17(14-16)24-15-20(21(25)23-12-5-2-6-13-23)30(27,28)19-11-4-3-10-18(19)24/h3-4,7-11,14-15H,2,5-6,12-13H2,1H3InChIKey
SIWIVBQXVROSQY-UHFFFAOYSA-NSynonyms
1251611-92-31251611923
COC(=O)C1=CC(=CC=C1)N2C=C(S(=O)(=O)C3=CC=CC=C32)C(=O)N4CCCCC4
InChI=1SC22H22N2O5Sc12922(26)1687917(1416)241520(21(25)23125261323)30(2728)1911431018(19)24h347111415H2561213H21H3
methyl3(11dioxido2(piperidin1ylcarbonyl)4H14benzothiazin4yl)benzoate
METHYL3(11DIOXIDO2(PIPERIDINE1CARBONYL)4HBENZO(B)(14)THIAZIN4YL)BENZOATE
methyl3(11dioxo2(piperidine1carbonyl)1$l^(6)4benzothiazin4yl)benzoate
MFCD16635779
ZINC000048988462
ZINC48988462
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