Vitas-M small molecule compound

N'-[(E)-{4-methoxy-3-[(2,2,3,3-tetrafluoropropoxy)methyl]phenyl}methylidene]-2-(4-oxoquinazolin-3(4H)-yl)acetohydrazide

Catalog ID
STK303026
SMILES COc1ccc(cc1COCC(C(F)F)(F)F)/C=N/NC(=O)Cn1cnc2c(c1=O)cccc2

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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 C22H20F4N4O4 MW 480.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20F4N4O4/c1-33-18-7-6-14(8-15(18)11-34-12-22(25,26)21(23)24)9-28-29-19(31)10-30-13-27-17-5-3-2-4-16(17)20(30)32/h2-9,13,21H,10-12H2,1H3,(H,29,31)/b28-9+
InChIKey
WVORUBMYBJGKFZ-HIUVJMHLSA-N
Synonyms
827588-44-3
827588443
COC1=C(C=C(C=C1)C=NNC(=O)CN2C=NC3=CC=CC=C3C2=O)COCC(C(F)F)(F)F
COc1ccc(cc1COCC(C(F)F)(F)F)C=NNC(=O)Cn1cnc2c(c1=O)cccc2
InChI=1SC22H20F4N4O4c133187614(815(18)11341222(2526)21(23)24)9282919(31)1030132717532416(17)20(30)32h291321H1012H21H3(H2931)b289+
MFCD04049085
N((E)(4methoxy3((2233tetrafluoropropoxy)methyl)phenyl)methylidene)2(4oxoquinazolin3(4H)yl)acetohydrazide
N((E)(4methoxy3(2233tetrafluoropropoxymethyl)phenyl)methylideneamino)2(4oxoquinazolin3yl)acetamide
ZINC000002758723
ZINC35657457

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.