Vitas-M small molecule compound

(2Z)-3-(1,3-benzodioxol-5-ylmethyl)-N-(2-methoxyphenyl)-4-oxo-2-(phenylimino)-1,3-thiazinane-6-carboxamide

Catalog ID
STK865185
SMILES COc1ccccc1NC(=O)C1CC(=O)N(/C(=N/c2ccccc2)/S1)Cc1ccc2c(c1)OCO2

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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 C26H23N3O5S MW 489.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H23N3O5S/c1-32-20-10-6-5-9-19(20)28-25(31)23-14-24(30)29(26(35-23)27-18-7-3-2-4-8-18)15-17-11-12-21-22(13-17)34-16-33-21/h2-13,23H,14-16H2,1H3,(H,28,31)/b27-26-
InChIKey
RPCGBSQUDVAUIU-RQZHXJHFSA-N
Synonyms
430426-82-7
(2Z)3(13benzodioxol5ylmethyl)N(2methoxyphenyl)4oxo2(phenylimino)13thiazinane6carboxamide
(Z)3(benzo(d)(13)dioxol5ylmethyl)N(2methoxyphenyl)4oxo2(phenylimino)13thiazinane6carboxamide
430426827
COc1ccccc1NC(=O)C1CC(=O)N(C(=Nc2ccccc2)S1)Cc1ccc2c(c1)OCO2
MFCD03680983
ZINC000008739439
ZINC000008739440

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Available files

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