Vitas-M small molecule compound
N-[(2-methyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-6-yl)sulfonyl]isovaline
Catalog ID
STK666644
SMILES CCC(C(=O)O)(NS(=O)(=O)c1ccc2c(c1)NC(=O)C(O2)C)C
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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 C14H18N2O6S MW 342.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H18N2O6S/c1-4-14(3,13(18)19)16-23(20,21)9-5-6-11-10(7-9)15-12(17)8(2)22-11/h5-8,16H,4H2,1-3H3,(H,15,17)(H,18,19)InChIKey
UNTSOLQOFSNPPC-UHFFFAOYSA-NSynonyms
2METHYL2(((2METHYL3OXO(2H4HBENZO(34E)14OXAZIN6YL))SULFONYL)AMINO)BUTANOICACID
2methyl2((2methyl3oxo4H14benzoxazin6yl)sulfonylamino)butanoicacid
CCC(C)(C(=O)O)NS(=O)(=O)C1=CC2=C(C=C1)OC(C(=O)N2)C
InChI=1SC14H18N2O6Sc1414(313(18)19)1623(2021)9561110(79)1512(17)8(2)2211h5816H4H213H3(H1517)(H1819)
MFCD10038443
N((2methyl3oxo34dihydro2H14benzoxazin6yl)sulfonyl)isovaline
ZINC000015083655
ZINC000015083661
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