Vitas-M small molecule compound

5-benzyl-3-(4,5-dimethoxy-2-nitrophenyl)-2-phenyldihydro-2H-pyrrolo[3,4-d][1,2]oxazole-4,6(3H,5H)-dione

Catalog ID
STL051264
SMILES COc1cc(c(cc1OC)[N+](=O)[O-])C1N(OC2C1C(=O)N(C2=O)Cc1ccccc1)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 C26H23N3O7 MW 489.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H23N3O7/c1-34-20-13-18(19(29(32)33)14-21(20)35-2)23-22-24(36-28(23)17-11-7-4-8-12-17)26(31)27(25(22)30)15-16-9-5-3-6-10-16/h3-14,22-24H,15H2,1-2H3
InChIKey
GOQVYQHWNBCKBV-UHFFFAOYSA-N
Synonyms
1022368-23-5
1022368235
5BENZYL3(45DIMETHOXY2NITROPHENYL)2PHENYL3A6ADIHYDRO3HPYRROLO(34D)(12)OXAZOLE46DIONE
5benzyl3(45dimethoxy2nitrophenyl)2phenyldihydro2Hpyrrolo(34d)(12)oxazole46(3H5H)dione
5benzyl3(45dimethoxy2nitrophenyl)2phenyldihydro2Hpyrrolo(34d)isoxazole46(5H6aH)dione
COC1=C(C=C(C(=C1)C2C3C(C(=O)N(C3=O)CC4=CC=CC=C4)ON2C5=CC=CC=C5)(N+)(=O)(O))OC
COc1cc(c(cc1OC)(N+)(=O)(O))C1N(OC2C1C(=O)N(C2=O)Cc1ccccc1)c1ccccc1
InChI=1SC26H23N3O7c134201318(19(29(32)33)1421(20)352)232224(3628(23)17117481217)26(31)27(25(22)30)151695361016h3142224H15H212H3
MFCD04164465
ZINC000017783698
ZINC000137523016

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Available files

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