Vitas-M small molecule compound
(2E)-3-methyl-1-oxo-2-({[4-(trifluoromethoxy)phenyl]amino}methylidene)-1,2-dihydropyrido[1,2-a]benzimidazole-4-carbonitrile
Catalog ID
STK991344
SMILES N#Cc1c(C)/c(=C\Nc2ccc(cc2)OC(F)(F)F)/c(=O)n2c1nc1c2cccc1
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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 C21H13F3N4O2 MW 410.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H13F3N4O2/c1-12-15(10-25)19-27-17-4-2-3-5-18(17)28(19)20(29)16(12)11-26-13-6-8-14(9-7-13)30-21(22,23)24/h2-9,11,26H,1H3/b16-11+InChIKey
FKYFZXGUFAACNR-LFIBNONCSA-NSynonyms
(2E)3methyl1oxo2(((4(trifluoromethoxy)phenyl)amino)methylidene)12dihydropyrido(12a)benzimidazole4carbonitrile
(2E)3methyl1oxo2((4(trifluoromethoxy)anilino)methylidene)pyrido(12a)benzimidazole4carbonitrile
CC1=C(C2=NC3=CC=CC=C3N2C(=O)C1=CNC4=CC=C(C=C4)OC(F)(F)F)C#N
InChI=1SC21H13F3N4O2c11215(1025)192717423518(17)28(19)20(29)16(12)1126136814(9713)3021(2223)24h291126H1H3b1611+
MFCD07801920
N#Cc1c(C)c(=CNc2ccc(cc2)OC(F)(F)F)c(=O)n2c1nc1c2cccc1
ZINC000005020273
ZINC05020273
ZINC5020273
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