Vitas-M small molecule compound

4-({[(2Z)-3-(1,3-benzodioxol-5-ylmethyl)-4-oxo-2-(phenylimino)-1,3-thiazinan-6-yl]carbonyl}amino)benzoic acid

Catalog ID
STK051992
SMILES O=C(C1CC(=O)N(/C(=N/c2ccccc2)/S1)Cc1ccc2c(c1)OCO2)Nc1ccc(cc1)C(=O)O

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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 C26H21N3O6S MW 503.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H21N3O6S/c30-23-13-22(24(31)27-19-9-7-17(8-10-19)25(32)33)36-26(28-18-4-2-1-3-5-18)29(23)14-16-6-11-20-21(12-16)35-15-34-20/h1-12,22H,13-15H2,(H,27,31)(H,32,33)/b28-26-
InChIKey
NXZZAWANMIORKB-SGEDCAFJSA-N
Synonyms
492452-21-8
(Z)4(3(benzo(d)(13)dioxol5ylmethyl)4oxo2(phenylimino)13thiazinane6carboxamido)benzoicacid
4((((2Z)3(13benzodioxol5ylmethyl)4oxo2(phenylimino)13thiazinan6yl)carbonyl)amino)benzoicacid
492452218
MFCD02230083
O=C(C1CC(=O)N(C(=Nc2ccccc2)S1)Cc1ccc2c(c1)OCO2)Nc1ccc(cc1)C(=O)O
STK051992
ZINC000013403430
ZINC000013403435

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Available files

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