Vitas-M small molecule compound

4-(4,6-dioxo-2,5-diphenylhexahydro-2H-pyrrolo[3,4-d][1,2]oxazol-3-yl)phenyl benzenesulfonate

Catalog ID
STL006401
SMILES O=C1C2C(c3ccc(cc3)OS(=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(20-16-18-23(19-17-20)37-38(34,35)24-14-8-3-9-15-24)31(22-12-6-2-7-13-22)36-27(25)29(33)30(28)21-10-4-1-5-11-21/h1-19,25-27H
InChIKey
GZQFZDNPGFECFD-UHFFFAOYSA-N
Synonyms
1212404-36-8
(4(46DIOXO25DIPHENYL3A6ADIHYDRO3HPYRROLO(34D)(12)OXAZOL3YL)PHENYL)BENZENESULFONATE
1212404368
4((3S3AR6AS)46DIOXO25DIPHENYLHEXAHYDRO2HPYRROLO(34D)(12)OXAZOL3YL)PHENYLBENZENESULFONATE
4(46dioxo25diphenylhexahydro2Hpyrrolo(34d)(12)oxazol3yl)phenylbenzenesulfonate
4(46dioxo25diphenylhexahydro2Hpyrrolo(34d)isoxazol3yl)phenylbenzenesulfonate
C1=CC=C(C=C1)N2C(C3C(O2)C(=O)N(C3=O)C4=CC=CC=C4)C5=CC=C(C=C5)OS(=O)(=O)C6=CC=CC=C6
InChI=1SC29H22N2O6Sc32282526(20161823(191720)3738(3435)24148391524)31(22126271322)3627(25)29(33)30(28)21104151121h1192527H
MFCD04167672
ZINC000002414884
ZINC000230011267

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Available files

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