Vitas-M small molecule compound
(5Z)-1-butyl-4-methyl-2,6-dioxo-5-({[3-(trifluoromethyl)phenyl]amino}methylidene)-1,2,5,6-tetrahydropyridine-3-carbonitrile
Catalog ID
STK991453
SMILES CCCCN1C(=O)/C(=C\Nc2cccc(c2)C(F)(F)F)/C(=C(C1=O)C#N)C
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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 C19H18F3N3O2 MW 377.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H18F3N3O2/c1-3-4-8-25-17(26)15(10-23)12(2)16(18(25)27)11-24-14-7-5-6-13(9-14)19(20,21)22/h5-7,9,11,24H,3-4,8H2,1-2H3/b16-11-InChIKey
ISEHLAKYVITIOR-WJDWOHSUSA-NSynonyms
(5Z)1butyl4methyl26dioxo5(((3(trifluoromethyl)phenyl)amino)methylidene)1256tetrahydropyridine3carbonitrile
(5Z)1BUTYL4METHYL26DIOXO5((3(TRIFLUOROMETHYL)ANILINO)METHYLIDENE)PYRIDINE3CARBONITRILE
CCCCN1C(=O)C(=CNC2=CC=CC(=C2)C(F)(F)F)C(=C(C1=O)C#N)C
CCCCN1C(=O)C(=CNc2cccc(c2)C(F)(F)F)C(=C(C1=O)C#N)C
InChI=1SC19H18F3N3O2c13482517(26)15(1023)12(2)16(18(25)27)11241475613(914)19(2021)22h5791124H348H212H3b1611
MFCD07802018
ZINC000005021826
ZINC05021826
ZINC5021826
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