Vitas-M small molecule compound
3-hydroxy-N-[1-hydroxy-4-(methylsulfanyl)butan-2-yl]-2H-1,4-benzoxazine-6-carboxamide
Catalog ID
STL425897
SMILES CSCCC(NC(=O)c1ccc2c(c1)N=C(CO2)O)CO
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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 C14H18N2O4S MW 310.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H18N2O4S/c1-21-5-4-10(7-17)15-14(19)9-2-3-12-11(6-9)16-13(18)8-20-12/h2-3,6,10,17H,4-5,7-8H2,1H3,(H,15,19)(H,16,18)InChIKey
KUSVYOXTHJBKPX-UHFFFAOYSA-NSynonyms
3hydroxyN(1hydroxy4(methylsulfanyl)butan2yl)2H14benzoxazine6carboxamide
CSCCC(CO)NC(=O)C1=CC2=C(C=C1)OCC(=O)N2
InChI=1SC14H18N2O4Sc1215410(717)1514(19)9231211(69)1613(18)82012h2361017H4578H21H3(H1519)(H1618)
MFCD30710248
N(1hydroxy4methylsulfanylbutan2yl)3oxo4H14benzoxazine6carboxamide
ZINC000252490479
ZINC000252490480
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