Vitas-M small molecule compound
(2Z)-3-[1-(4-nitrophenyl)-3-phenyl-1H-pyrazol-4-yl]-2-(4-oxo-3,4-dihydroquinazolin-2-yl)prop-2-enenitrile
Catalog ID
STK817940
SMILES N#C/C(=C/c1cn(nc1c1ccccc1)c1ccc(cc1)[N+](=O)[O-])/c1nc2ccccc2c(=O)[nH]1
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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 C26H16N6O3 MW 460.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H16N6O3/c27-15-18(25-28-23-9-5-4-8-22(23)26(33)29-25)14-19-16-31(20-10-12-21(13-11-20)32(34)35)30-24(19)17-6-2-1-3-7-17/h1-14,16H,(H,28,29,33)/b18-14-InChIKey
YAQKZIBCRNJZEQ-JXAWBTAJSA-NSynonyms
(2Z)3(1(4nitrophenyl)3phenyl1Hpyrazol4yl)2(4oxo34dihydroquinazolin2yl)prop2enenitrile
(Z)3(1(4nitrophenyl)3phenylpyrazol4yl)2(4oxo1Hquinazolin2yl)prop2enenitrile
C1=CC=C(C=C1)C2=NN(C=C2C=C(C#N)C3=NC(=O)C4=CC=CC=C4N3)C5=CC=C(C=C5)(N+)(=O)(O)
InChI=1SC26H16N6O3c271518(252823954822(23)26(33)2925)14191631(20101221(131120)32(34)35)3024(19)176213717h11416H(H282933)b1814
MFCD04447650
N#CC(=Cc1cn(nc1c1ccccc1)c1ccc(cc1)(N+)(=O)(O))c1nc2ccccc2c(=O)(nH)1
ZINC000009972297
ZINC9972297
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