Vitas-M small molecule compound
2-(4,6-dioxo-2,5-diphenylhexahydro-2H-pyrrolo[3,4-d][1,2]oxazol-3-yl)phenyl benzenesulfonate
Catalog ID
STL007042
SMILES O=C1C2C(c3ccccc3OS(=O)(=O)c3ccccc3)N(OC2C(=O)N1c1ccccc1)c1ccccc1
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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 C29H22N2O6S MW 526.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H22N2O6S/c32-28-25-26(23-18-10-11-19-24(23)37-38(34,35)22-16-8-3-9-17-22)31(21-14-6-2-7-15-21)36-27(25)29(33)30(28)20-12-4-1-5-13-20/h1-19,25-27HInChIKey
MNBFKRRRPRIYNW-UHFFFAOYSA-NSynonyms
1212293-70-3(2(46DIOXO25DIPHENYL3A6ADIHYDRO3HPYRROLO(34D)(12)OXAZOL3YL)PHENYL)BENZENESULFONATE
1212293703
2((3S3AR6AS)46DIOXO25DIPHENYLHEXAHYDRO2HPYRROLO(34D)(12)OXAZOL3YL)PHENYLBENZENESULFONATE
2(46dioxo25diphenylhexahydro2Hpyrrolo(34d)(12)oxazol3yl)phenylbenzenesulfonate
2(46dioxo25diphenylhexahydro2Hpyrrolo(34d)isoxazol3yl)phenylbenzenesulfonate
C1=CC=C(C=C1)N2C(C3C(O2)C(=O)N(C3=O)C4=CC=CC=C4)C5=CC=CC=C5OS(=O)(=O)C6=CC=CC=C6
InChI=1SC29H22N2O6Sc32282526(231810111924(23)3738(3435)22168391722)31(21146271521)3627(25)29(33)30(28)20124151320h1192527H
MFCD04170250
ZINC000002417860
ZINC000230012883
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