Vitas-M small molecule compound
4-{[(3-hydroxy-7-methoxy-2H-1,4-benzothiazin-2-yl)acetyl]amino}benzoic acid
Catalog ID
STL155500
SMILES COc1ccc2c(c1)SC(C(=N2)O)CC(=O)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 C18H16N2O5S MW 372.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16N2O5S/c1-25-12-6-7-13-14(8-12)26-15(17(22)20-13)9-16(21)19-11-4-2-10(3-5-11)18(23)24/h2-8,15H,9H2,1H3,(H,19,21)(H,20,22)(H,23,24)InChIKey
AQVIJQWBQXNBSQ-UHFFFAOYSA-NSynonyms
1282115-62-11282115621
4(((3hydroxy7methoxy2H14benzothiazin2yl)acetyl)amino)benzoicacid
4((2(7methoxy3oxo4H14benzothiazin2yl)acetyl)amino)benzoicacid
COC1=CC2=C(C=C1)NC(=O)C(S2)CC(=O)NC3=CC=C(C=C3)C(=O)O
InChI=1SC18H16N2O5Sc12512671314(812)2615(17(22)2013)916(21)19114210(3511)18(23)24h2815H9H21H3(H1921)(H2022)(H2324)
MFCD20757328
ZINC000061720351
ZINC000061720352
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