Vitas-M small molecule compound
(2Z)-2-({1-[3-(trifluoromethyl)phenyl]-1H-pyrrol-2-yl}methylidene)[1,3]thiazolo[3,2-a]benzimidazol-3(2H)-one
Catalog ID
STK178625
SMILES O=c1/c(=C/c2cccn2c2cccc(c2)C(F)(F)F)/sc2n1c1ccccc1n2
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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 C21H12F3N3OS MW 411.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H12F3N3OS/c22-21(23,24)13-5-3-6-14(11-13)26-10-4-7-15(26)12-18-19(28)27-17-9-2-1-8-16(17)25-20(27)29-18/h1-12H/b18-12-InChIKey
BYRDSUKECBACEL-PDGQHHTCSA-NSynonyms
(2Z)2((1(3(TRIFLUOROMETHYL)PHENYL)1HPYRROL2YL)METHYLIDENE)(13)THIAZOLO(32A)BENZIMIDAZOL3(2H)ONE
(2Z)2((1(3(TRIFLUOROMETHYL)PHENYL)PYRROL2YL)METHYLIDENE)(13)THIAZOLO(32A)BENZIMIDAZOL1ONE
C1=CC=C2C(=C1)N=C3N2C(=O)C(=CC4=CC=CN4C5=CC=CC(=C5)C(F)(F)F)S3
InChI=1SC21H12F3N3OSc2221(2324)1353614(1113)26104715(26)121819(28)2717921816(17)2520(27)2918h112Hb1812
MFCD03078965
O=c1c(=Cc2cccn2c2cccc(c2)C(F)(F)F)sc2n1c1ccccc1n2
ZINC000004704881
ZINC04704881
ZINC4704881
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