Vitas-M small molecule compound
(2Z)-3-[3-(1-benzofuran-2-yl)-1-phenyl-1H-pyrazol-4-yl]-2-(4-oxo-3,4-dihydroquinazolin-2-yl)prop-2-enenitrile
Catalog ID
STK705787
SMILES N#C/C(=C/c1cn(nc1c1cc2c(o1)cccc2)c1ccccc1)/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 C28H17N5O2 MW 455.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H17N5O2/c29-16-19(27-30-23-12-6-5-11-22(23)28(34)31-27)14-20-17-33(21-9-2-1-3-10-21)32-26(20)25-15-18-8-4-7-13-24(18)35-25/h1-15,17H,(H,30,31,34)/b19-14-InChIKey
YBLBMMHXPKJWGD-RGEXLXHISA-NSynonyms
(2Z)3(3(1benzofuran2yl)1phenyl1Hpyrazol4yl)2(4oxo34dihydroquinazolin2yl)prop2enenitrile
(Z)3(3(1benzofuran2yl)1phenylpyrazol4yl)2(4oxo1Hquinazolin2yl)prop2enenitrile
C1=CC=C(C=C1)N2C=C(C(=N2)C3=CC4=CC=CC=C4O3)C=C(C#N)C5=NC(=O)C6=CC=CC=C6N5
InChI=1SC28H17N5O2c291619(27302312651122(23)28(34)3127)14201733(2192131021)3226(20)2515188471324(18)3525h11517H(H303134)b1914
MFCD06642776
N#CC(=Cc1cn(nc1c1cc2c(o1)cccc2)c1ccccc1)c1nc2ccccc2c(=O)(nH)1
ZINC000016734843
ZINC16734843
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