Vitas-M small molecule compound

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

Catalog ID
STK570000
SMILES Cc1ccc(cc1)C1N(OC2C1C(=O)N(C2=O)Cc1ccccc1)c1cccc(c1)[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/c1-16-10-12-18(13-11-16)22-21-23(33-27(22)19-8-5-9-20(14-19)28(31)32)25(30)26(24(21)29)15-17-6-3-2-4-7-17/h2-14,21-23H,15H2,1H3
InChIKey
FKUSPIUAIQCNHS-UHFFFAOYSA-N
Synonyms
1024450-38-1
1024450381
5benzyl2(3nitrophenyl)3(ptolyl)dihydro2Hpyrrolo(34d)isoxazole46(5H6aH)dione
5BENZYL3(4METHYLPHENYL)2(3NITROPHENYL)3A6ADIHYDRO3HPYRROLO(34D)(12)OXAZOLE46DIONE
5benzyl3(4methylphenyl)2(3nitrophenyl)dihydro2Hpyrrolo(34d)(12)oxazole46(3H5H)dione
CC1=CC=C(C=C1)C2C3C(C(=O)N(C3=O)CC4=CC=CC=C4)ON2C5=CC(=CC=C5)(N+)(=O)(O)
Cc1ccc(cc1)C1N(OC2C1C(=O)N(C2=O)Cc1ccccc1)c1cccc(c1)(N+)(=O)(O)
InChI=1SC25H21N3O5c116101218(131116)222123(3327(22)1985920(1419)28(31)32)25(30)26(24(21)29)15176324717h2142123H15H21H3
MFCD04188937
ZINC000018120493
ZINC000143600415

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Available files

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