Vitas-M small molecule compound
2-[2-(1,3-benzodioxol-5-ylamino)-2-oxoethyl]-3-hydroxy-2H-1,4-benzothiazine-7-carboxylic acid
Catalog ID
STL162036
SMILES O=C(CC1Sc2cc(ccc2N=C1O)C(=O)O)Nc1ccc2c(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 C18H14N2O6S MW 386.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H14N2O6S/c21-16(19-10-2-4-12-13(6-10)26-8-25-12)7-15-17(22)20-11-3-1-9(18(23)24)5-14(11)27-15/h1-6,15H,7-8H2,(H,19,21)(H,20,22)(H,23,24)InChIKey
LLKMYTVPJSPIQP-UHFFFAOYSA-NSynonyms
1282120-30-21282120302
2(2(13benzodioxol5ylamino)2oxoethyl)3hydroxy2H14benzothiazine7carboxylicacid
2(2(13benzodioxol5ylamino)2oxoethyl)3oxo4H14benzothiazine7carboxylicacid
C1OC2=C(O1)C=C(C=C2)NC(=O)CC3C(=O)NC4=C(S3)C=C(C=C4)C(=O)O
InChI=1SC18H14N2O6Sc2116(1910241213(610)2682512)71517(22)2011319(18(23)24)514(11)2715h1615H78H2(H1921)(H2022)(H2324)
MFCD20759552
ZINC000061720618
ZINC000061720619
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