Vitas-M small molecule compound

(2Z)-2-(1,3-benzothiazol-2-yl)-3-(3-{3-[(4-fluorobenzyl)oxy]phenyl}-1-phenyl-1H-pyrazol-4-yl)prop-2-enenitrile

Catalog ID
STK706827
SMILES N#C/C(=C/c1cn(nc1c1cccc(c1)OCc1ccc(cc1)F)c1ccccc1)/c1nc2c(s1)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 C32H21FN4OS MW 528.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H21FN4OS/c33-26-15-13-22(14-16-26)21-38-28-10-6-7-23(18-28)31-25(20-37(36-31)27-8-2-1-3-9-27)17-24(19-34)32-35-29-11-4-5-12-30(29)39-32/h1-18,20H,21H2/b24-17-
InChIKey
CJLIEGOSGPAOKD-ULJHMMPZSA-N
Synonyms
1009188-13-9
(2Z)2(13benzothiazol2yl)3(3(3((4fluorobenzyl)oxy)phenyl)1phenyl1Hpyrazol4yl)prop2enenitrile
(Z)2(13benzothiazol2yl)3(3(3((4fluorophenyl)methoxy)phenyl)1phenylpyrazol4yl)prop2enenitrile
(Z)2(benzo(d)thiazol2yl)3(3(3((4fluorobenzyl)oxy)phenyl)1phenyl1Hpyrazol4yl)acrylonitrile
1009188139
C1=CC=C(C=C1)N2C=C(C(=N2)C3=CC(=CC=C3)OCC4=CC=C(C=C4)F)C=C(C#N)C5=NC6=CC=CC=C6S5
InChI=1SC32H21FN4OSc3326151322(141626)213828106723(1828)3125(2037(3631)278213927)1724(1934)32352911451230(29)3932h11820H21H2b2417
MFCD04008891
N#CC(=Cc1cn(nc1c1cccc(c1)OCc1ccc(cc1)F)c1ccccc1)c1nc2c(s1)cccc2
ZINC000101034142
ZINC101034142

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Available files

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