Vitas-M small molecule compound
4-[3-(2-nitrophenyl)-4,6-dioxo-2-phenylhexahydro-5H-pyrrolo[3,4-d][1,2]oxazol-5-yl]benzonitrile
Catalog ID
STL054798
SMILES N#Cc1ccc(cc1)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 C24H16N4O5 MW 440.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H16N4O5/c25-14-15-10-12-16(13-11-15)26-23(29)20-21(18-8-4-5-9-19(18)28(31)32)27(33-22(20)24(26)30)17-6-2-1-3-7-17/h1-13,20-22HInChIKey
GMUJGWHJIQSGGT-UHFFFAOYSA-NSynonyms
1024172-50-61024172506
4(3(2NITROPHENYL)46DIOXO2PHENYL3A6ADIHYDRO3HPYRROLO(34D)(12)OXAZOL5YL)BENZONITRILE
4(3(2nitrophenyl)46dioxo2phenylhexahydro5Hpyrrolo(34d)(12)oxazol5yl)benzonitrile
4(3(2nitrophenyl)46dioxo2phenyltetrahydro2Hpyrrolo(34d)isoxazol5(3H)yl)benzonitrile
C1=CC=C(C=C1)N2C(C3C(O2)C(=O)N(C3=O)C4=CC=C(C=C4)C#N)C5=CC=CC=C5(N+)(=O)(O)
InChI=1SC24H16N4O5c251415101216(131115)2623(29)2021(18845919(18)28(31)32)27(3322(20)24(26)30)176213717h1132022H
MFCD05689179
N#Cc1ccc(cc1)N1C(=O)C2C(C1=O)C(N(O2)c1ccccc1)c1ccccc1(N+)(=O)(O)
ZINC000001315865
ZINC000229941866
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