Vitas-M small molecule compound

4-[5-(3-methoxyphenyl)-4,6-dioxo-2-phenylhexahydro-2H-pyrrolo[3,4-d][1,2]oxazol-3-yl]benzonitrile

Catalog ID
STL006724
SMILES N#Cc1ccc(cc1)C1N(OC2C1C(=O)N(C2=O)c1cccc(c1)OC)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 C25H19N3O4 MW 425.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H19N3O4/c1-31-20-9-5-8-19(14-20)27-24(29)21-22(17-12-10-16(15-26)11-13-17)28(32-23(21)25(27)30)18-6-3-2-4-7-18/h2-14,21-23H,1H3
InChIKey
HKOMONGSAWTIIM-UHFFFAOYSA-N
Synonyms
1022667-32-8
1022667328
4(5(3METHOXYPHENYL)46DIOXO2PHENYL3A6ADIHYDRO3HPYRROLO(34D)(12)OXAZOL3YL)BENZONITRILE
4(5(3methoxyphenyl)46dioxo2phenylhexahydro2Hpyrrolo(34d)(12)oxazol3yl)benzonitrile
4(5(3methoxyphenyl)46dioxo2phenylhexahydro2Hpyrrolo(34d)isoxazol3yl)benzonitrile
COC1=CC=CC(=C1)N2C(=O)C3C(N(OC3C2=O)C4=CC=CC=C4)C5=CC=C(C=C5)C#N
InChI=1SC25H19N3O4c1312095819(1420)2724(29)2122(17121016(1526)111317)28(3223(21)25(27)30)186324718h2142123H1H3
MFCD05681023
ZINC000102760042
ZINC000230034725

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Available files

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