Vitas-M small molecule compound
2-methyl-2-[(6-nitro-1,1-dioxido-1,2-benzothiazol-3-yl)amino]propane-1,3-diol
Catalog ID
STL287136
SMILES OCC(NC1=NS(=O)(=O)c2c1ccc(c2)[N+](=O)[O-])(CO)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 C11H13N3O6S MW 315.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C11H13N3O6S/c1-11(5-15,6-16)12-10-8-3-2-7(14(17)18)4-9(8)21(19,20)13-10/h2-4,15-16H,5-6H2,1H3,(H,12,13)InChIKey
IFDGNOTZVQDFSK-UHFFFAOYSA-NSynonyms
2methyl2((6nitro11dioxido12benzothiazol3yl)amino)propane13diol
2methyl2((6nitro11dioxo12benzothiazol3yl)amino)propane13diol
CC(CO)(CO)NC1=NS(=O)(=O)C2=C1C=CC(=C2)(N+)(=O)(O)
InChI=1SC11H13N3O6Sc111(515616)12108327(14(17)18)49(8)21(1920)1310h241516H56H21H3(H1213)
MFCD24847406
OCC(NC1=NS(=O)(=O)c2c1ccc(c2)(N+)(=O)(O))(CO)C
ZINC000095481804
ZINC95481804
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