Vitas-M small molecule compound
(2E)-3-[5-(4-bromophenyl)furan-2-yl]-2-(4-oxo-3,4-dihydroquinazolin-2-yl)prop-2-enenitrile
Catalog ID
STL017177
SMILES N#C/C(=C\c1ccc(o1)c1ccc(cc1)Br)/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 C21H12BrN3O2 MW 418.25 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H12BrN3O2/c22-15-7-5-13(6-8-15)19-10-9-16(27-19)11-14(12-23)20-24-18-4-2-1-3-17(18)21(26)25-20/h1-11H,(H,24,25,26)/b14-11+InChIKey
AJULFOAXVRFOBA-SDNWHVSQSA-NSynonyms
(2E)3(5(4bromophenyl)furan2yl)2(4oxo34dihydroquinazolin2yl)prop2enenitrile
(E)3(5(4BROMOPHENYL)FURAN2YL)2(4OXO1HQUINAZOLIN2YL)PROP2ENENITRILE
C1=CC=C2C(=C1)C(=O)N=C(N2)C(=CC3=CC=C(O3)C4=CC=C(C=C4)Br)C#N
InChI=1SC21H12BrN3O2c22157513(6815)1910916(2719)1114(1223)202418421317(18)21(26)2520h111H(H242526)b1411+
MFCD05827074
N#CC(=Cc1ccc(o1)c1ccc(cc1)Br)c1nc2ccccc2c(=O)(nH)1
ZINC000006143638
ZINC6143638
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