Vitas-M small molecule compound

(2Z)-2-cyano-3-(3-{3-[(4-fluorobenzyl)oxy]phenyl}-1-phenyl-1H-pyrazol-4-yl)-N-[3-(1H-imidazol-1-yl)propyl]prop-2-enamide

Catalog ID
STK706821
SMILES N#C/C(=C/c1cn(nc1c1cccc(c1)OCc1ccc(cc1)F)c1ccccc1)/C(=O)NCCCn1cncc1

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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 C32H27FN6O2 MW 546.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H27FN6O2/c33-28-12-10-24(11-13-28)22-41-30-9-4-6-25(19-30)31-27(21-39(37-31)29-7-2-1-3-8-29)18-26(20-34)32(40)36-14-5-16-38-17-15-35-23-38/h1-4,6-13,15,17-19,21,23H,5,14,16,22H2,(H,36,40)/b26-18-
InChIKey
DJWIMNQNQGHKNG-ITYLOYPMSA-N
Synonyms
958973-73-4
(2Z)2cyano3(3(3((4fluorobenzyl)oxy)phenyl)1phenyl1Hpyrazol4yl)N(3(1Himidazol1yl)propyl)prop2enamide
(Z)2cyano3(3(3((4fluorophenyl)methoxy)phenyl)1phenylpyrazol4yl)N(3imidazol1ylpropyl)prop2enamide
(Z)2CYANO3(3(3(4FLUOROBENZYLOXY)PHENYL)1PHENYL1HPYRAZOL4YL)N(3IMIDAZOL1YLPROPYL)ACRYLAMIDE
(Z)N(3(1Himidazol1yl)propyl)2cyano3(3(3((4fluorobenzyl)oxy)phenyl)1phenyl1Hpyrazol4yl)acrylamide
958973734
C1=CC=C(C=C1)N2C=C(C(=N2)C3=CC(=CC=C3)OCC4=CC=C(C=C4)F)C=C(C#N)C(=O)NCCCN5C=CN=C5
InChI=1SC32H27FN6O2c3328121024(111328)22413094625(1930)3127(2139(3731)297213829)1826(2034)32(40)3614516381715352338h146131517192123H5141622H2(H3640)b2618
MFCD04019541
N#CC(=Cc1cn(nc1c1cccc(c1)OCc1ccc(cc1)F)c1ccccc1)C(=O)NCCCn1cncc1
ZINC000008683410
ZINC8683410

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Available files

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