Vitas-M small molecule compound
3-(4-{[(6-methyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-7-yl)sulfonyl]amino}phenyl)propanoic acid
Catalog ID
STK666413
SMILES OC(=O)CCc1ccc(cc1)NS(=O)(=O)c1cc2OCC(=O)Nc2cc1C
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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 C18H18N2O6S MW 390.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18N2O6S/c1-11-8-14-15(26-10-17(21)19-14)9-16(11)27(24,25)20-13-5-2-12(3-6-13)4-7-18(22)23/h2-3,5-6,8-9,20H,4,7,10H2,1H3,(H,19,21)(H,22,23)InChIKey
PYQXTGDGAJBSOE-UHFFFAOYSA-NSynonyms
3(4(((6methyl3oxo34dihydro2H14benzoxazin7yl)sulfonyl)amino)phenyl)propanoicacid
3(4((6methyl3oxo4H14benzoxazin7yl)sulfonylamino)phenyl)propanoicacid
CC1=CC2=C(C=C1S(=O)(=O)NC3=CC=C(C=C3)CCC(=O)O)OCC(=O)N2
InChI=1SC18H18N2O6Sc11181415(261017(21)1914)916(11)27(2425)20135212(3613)4718(22)23h23568920H4710H21H3(H1921)(H2223)
MFCD09063806
ZINC000012446840
ZINC12446840
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