Vitas-M small molecule compound
(2Z)-2-(1,3-benzothiazol-2-yl)-3-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}prop-2-enenitrile
Catalog ID
STK991456
SMILES N#C/C(=C/N1CCN(CC1)c1cccc(c1)C(F)(F)F)/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 C21H17F3N4S MW 414.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17F3N4S/c22-21(23,24)16-4-3-5-17(12-16)28-10-8-27(9-11-28)14-15(13-25)20-26-18-6-1-2-7-19(18)29-20/h1-7,12,14H,8-11H2/b15-14-InChIKey
YQYIZPWMHQQFNL-PFONDFGASA-NSynonyms
883278-96-4(2Z)2(13benzothiazol2yl)3(4(3(trifluoromethyl)phenyl)piperazin1yl)prop2enenitrile
(Z)2(13BENZOTHIAZOL2YL)3(4(3(TRIFLUOROMETHYL)PHENYL)PIPERAZIN1YL)PROP2ENENITRILE
883278964
C1CN(CCN1C=C(C#N)C2=NC3=CC=CC=C3S2)C4=CC=CC(=C4)C(F)(F)F
InChI=1SC21H17F3N4Sc2221(2324)1643517(1216)2810827(91128)1415(1325)202618612719(18)2920h171214H811H2b1514
MFCD07802023
N#CC(=CN1CCN(CC1)c1cccc(c1)C(F)(F)F)c1nc2c(s1)cccc2
ZINC000005021831
ZINC05021831
ZINC5021831
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