Vitas-M small molecule compound

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

Catalog ID
STL049247
SMILES Cc1ccc(c(c1)C)N1C(=O)C2C(C1=O)C(N(O2)c1ccccc1)c1ccccc1[N+](=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 C25H21N3O5 MW 443.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H21N3O5/c1-15-12-13-19(16(2)14-15)26-24(29)21-22(18-10-6-7-11-20(18)28(31)32)27(33-23(21)25(26)30)17-8-4-3-5-9-17/h3-14,21-23H,1-2H3
InChIKey
IVBAGKFXHHRVFK-UHFFFAOYSA-N
Synonyms
1024387-41-4
1024387414
5(24DIMETHYLPHENYL)3(2NITROPHENYL)2PHENYL3A6ADIHYDRO3HPYRROLO(34D)(12)OXAZOLE46DIONE
5(24dimethylphenyl)3(2nitrophenyl)2phenyldihydro2Hpyrrolo(34d)(12)oxazole46(3H5H)dione
5(24dimethylphenyl)3(2nitrophenyl)2phenyldihydro2Hpyrrolo(34d)isoxazole46(5H6aH)dione
CC1=CC(=C(C=C1)N2C(=O)C3C(N(OC3C2=O)C4=CC=CC=C4)C5=CC=CC=C5(N+)(=O)(O))C
Cc1ccc(c(c1)C)N1C(=O)C2C(C1=O)C(N(O2)c1ccccc1)c1ccccc1(N+)(=O)(O)
InChI=1SC25H21N3O5c115121319(16(2)1415)2624(29)2122(1810671120(18)28(31)32)27(3323(21)25(26)30)178435917h3142123H12H3
MFCD05698182
ZINC000102766006
ZINC000245246111

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Available files

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