Vitas-M small molecule compound
(2E)-2-(4-hydroxyquinazolin-2(1H)-ylidene)-3-(4-nitrophenyl)-3-oxopropanenitrile
Catalog ID
STK594515
SMILES N#C/C(=c/1\nc(O)c2c([nH]1)cccc2)/C(=O)c1ccc(cc1)[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 C17H10N4O4 MW 334.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H10N4O4/c18-9-13(15(22)10-5-7-11(8-6-10)21(24)25)16-19-14-4-2-1-3-12(14)17(23)20-16/h1-8,19H,(H,20,23)/b16-13+InChIKey
QEEGPIOQCNHKDZ-DTQAZKPQSA-NSynonyms
(2E)2(4hydroxyquinazolin2(1H)ylidene)3(4nitrophenyl)3oxopropanenitrile
(2E)3(4NITROPHENYL)3OXO2(4OXO1HQUINAZOLIN2YLIDENE)PROPANENITRILE
3(4NITROPHENYL)3OXO2(4OXO(13DIHYDROQUINAZOLIN2YLIDENE))PROPANENITRILE
C1=CC=C2C(=C1)C(=O)NC(=C(C#N)C(=O)C3=CC=C(C=C3)(N+)(=O)(O))N2
InChI=1SC17H10N4O4c18913(15(22)105711(8610)21(24)25)161914421312(14)17(23)2016h1819H(H2023)b1613+
MFCD07201312
N#CC(=c1nc(O)c2c((nH)1)cccc2)C(=O)c1ccc(cc1)(N+)(=O)(O)
ZINC000018213161
ZINC18213161
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