Vitas-M small molecule compound
2-[2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-oxoethyl]-3-hydroxy-2H-1,4-benzothiazine-7-carboxylic acid
Catalog ID
STL152073
SMILES O=C(CC1Sc2cc(ccc2N=C1O)C(=O)O)Nc1ccc2c(c1)OCCO2
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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 C19H16N2O6S MW 400.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H16N2O6S/c22-17(20-11-2-4-13-14(8-11)27-6-5-26-13)9-16-18(23)21-12-3-1-10(19(24)25)7-15(12)28-16/h1-4,7-8,16H,5-6,9H2,(H,20,22)(H,21,23)(H,24,25)InChIKey
VBYGJTKYASIIHC-UHFFFAOYSA-NSynonyms
1282127-03-01282127030
2(2(23dihydro14benzodioxin6ylamino)2oxoethyl)3hydroxy2H14benzothiazine7carboxylicacid
2(2(23dihydro14benzodioxin6ylamino)2oxoethyl)3oxo4H14benzothiazine7carboxylicacid
C1COC2=C(O1)C=CC(=C2)NC(=O)CC3C(=O)NC4=C(S3)C=C(C=C4)C(=O)O
InChI=1SC19H16N2O6Sc2217(2011241314(811)27652613)91618(23)21123110(19(24)25)715(12)2816h147816H569H2(H2022)(H2123)(H2425)
MFCD20756221
ZINC000061719622
ZINC000061719623
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