Vitas-M small molecule compound

5-(3-ethoxyphenyl)-2-(3-nitrophenyl)-3-(2,3,4-trimethoxyphenyl)dihydro-2H-pyrrolo[3,4-d][1,2]oxazole-4,6(3H,5H)-dione

Catalog ID
STL056098
SMILES CCOc1cccc(c1)N1C(=O)C2C(C1=O)C(N(O2)c1cccc(c1)[N+](=O)[O-])c1ccc(c(c1OC)OC)OC

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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 C28H27N3O9 MW 549.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H27N3O9/c1-5-39-19-11-7-8-16(15-19)29-27(32)22-23(20-12-13-21(36-2)25(38-4)24(20)37-3)30(40-26(22)28(29)33)17-9-6-10-18(14-17)31(34)35/h6-15,22-23,26H,5H2,1-4H3
InChIKey
IWQXEEHDZDOYMZ-UHFFFAOYSA-N
Synonyms
1023036-84-1
1023036841
5(3ETHOXYPHENYL)2(3NITROPHENYL)3(234TRIMETHOXYPHENYL)3A6ADIHYDRO3HPYRROLO(34D)(12)OXAZOLE46DIONE
5(3ethoxyphenyl)2(3nitrophenyl)3(234trimethoxyphenyl)dihydro2Hpyrrolo(34d)(12)oxazole46(3H5H)dione
5(3ethoxyphenyl)2(3nitrophenyl)3(234trimethoxyphenyl)dihydro2Hpyrrolo(34d)isoxazole46(5H6aH)dione
CCOC1=CC=CC(=C1)N2C(=O)C3C(N(OC3C2=O)C4=CC(=CC=C4)(N+)(=O)(O))C5=C(C(=C(C=C5)OC)OC)OC
CCOc1cccc(c1)N1C(=O)C2C(C1=O)C(N(O2)c1cccc(c1)(N+)(=O)(O))c1ccc(c(c1OC)OC)OC
InChI=1SC28H27N3O9c153919117816(1519)2927(32)2223(20121321(362)25(384)24(20)373)30(4026(22)28(29)33)17961018(1417)31(34)35h615222326H5H214H3
MFCD05679934
ZINC000102759660
ZINC000245246113

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Available files

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