Vitas-M small molecule compound

(2Z)-3-[4-(3-methylbutoxy)phenyl]-2-(4-oxo-3,4-dihydroquinazolin-2-yl)prop-2-enenitrile

Catalog ID
STK817928
SMILES N#C/C(=C/c1ccc(cc1)OCCC(C)C)/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 C22H21N3O2 MW 359.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21N3O2/c1-15(2)11-12-27-18-9-7-16(8-10-18)13-17(14-23)21-24-20-6-4-3-5-19(20)22(26)25-21/h3-10,13,15H,11-12H2,1-2H3,(H,24,25,26)/b17-13-
InChIKey
UGNYWCFTQNQORW-LGMDPLHJSA-N
Synonyms
622348-56-5
(2Z)3(4(3methylbutoxy)phenyl)2(4oxo34dihydroquinazolin2yl)prop2enenitrile
(Z)3(4(3METHYLBUTOXY)PHENYL)2(4OXO1HQUINAZOLIN2YL)PROP2ENENITRILE
622348565
CC(C)CCOC1=CC=C(C=C1)C=C(C#N)C2=NC(=O)C3=CC=CC=C3N2
InChI=1SC22H21N3O2c115(2)111227189716(81018)1317(1423)212420643519(20)22(26)2521h3101315H1112H212H3(H242526)b1713
MFCD04447641
N#CC(=Cc1ccc(cc1)OCCC(C)C)c1nc2ccccc2c(=O)(nH)1
ZINC000004170209
ZINC4170209

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Available files

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