Vitas-M small molecule compound

ethyl 4-[3-(4-methylphenyl)-4,6-dioxo-2-phenylhexahydro-5H-pyrrolo[3,4-d][1,2]oxazol-5-yl]benzoate

Catalog ID
STL020308
SMILES CCOC(=O)c1ccc(cc1)N1C(=O)C2C(C1=O)C(N(O2)c1ccccc1)c1ccc(cc1)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 C27H24N2O5 MW 456.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H24N2O5/c1-3-33-27(32)19-13-15-20(16-14-19)28-25(30)22-23(18-11-9-17(2)10-12-18)29(34-24(22)26(28)31)21-7-5-4-6-8-21/h4-16,22-24H,3H2,1-2H3
InChIKey
RTCSXXQUPAKSCE-UHFFFAOYSA-N
Synonyms
1005085-25-5
1005085255
CCOC(=O)C1=CC=C(C=C1)N2C(=O)C3C(N(OC3C2=O)C4=CC=CC=C4)C5=CC=C(C=C5)C
ETHYL4(3(4METHYLPHENYL)46DIOXO2PHENYL3A6ADIHYDRO3HPYRROLO(34D)(12)OXAZOL5YL)BENZOATE
ethyl4(3(4methylphenyl)46dioxo2phenylhexahydro5Hpyrrolo(34d)(12)oxazol5yl)benzoate
ETHYL4(46DIOXO2PHENYL3(PTOLYL)TETRAHYDRO2HPYRROLO(34D)ISOXAZOL5(3H)YL)BENZOATE
InChI=1SC27H24N2O5c133327(32)19131520(161419)2825(30)2223(1811917(2)101218)29(3424(22)26(28)31)217546821h4162224H3H212H3
MFCD02970699
ZINC000102862085
ZINC000238924296

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Available files

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