Vitas-M small molecule compound
2-[5-(3-ethoxyphenyl)-4,6-dioxo-2-phenylhexahydro-2H-pyrrolo[3,4-d][1,2]oxazol-3-yl]benzoic acid
Catalog ID
STL349225
SMILES CCOc1cccc(c1)N1C(=O)C2C(C1=O)C(N(O2)c1ccccc1)c1ccccc1C(=O)O
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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 C26H22N2O6 MW 458.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H22N2O6/c1-2-33-18-12-8-11-17(15-18)27-24(29)21-22(19-13-6-7-14-20(19)26(31)32)28(34-23(21)25(27)30)16-9-4-3-5-10-16/h3-15,21-23H,2H2,1H3,(H,31,32)InChIKey
MXEXZYNIEJUBQB-UHFFFAOYSA-NSynonyms
1022456-20-71022456207
2(5(3ETHOXYPHENYL)46DIOXO2PHENYL3A6ADIHYDRO3HPYRROLO(34D)(12)OXAZOL3YL)BENZOICACID
2(5(3ethoxyphenyl)46dioxo2phenylhexahydro2Hpyrrolo(34d)(12)oxazol3yl)benzoicacid
2(5(3ETHOXYPHENYL)46DIOXO2PHENYLHEXAHYDRO2HPYRROLO(34D)ISOXAZOL3YL)BENZOICACID
CCOC1=CC=CC(=C1)N2C(=O)C3C(N(OC3C2=O)C4=CC=CC=C4)C5=CC=CC=C5C(=O)O
InChI=1SC26H22N2O6c1233181281117(1518)2724(29)2122(1913671420(19)26(31)32)28(3423(21)25(27)30)1694351016h3152123H2H21H3(H3132)
MFCD05701941
ZINC000102767279
ZINC000245311306
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