Vitas-M small molecule compound
2-{[3-(2-oxo-2,3-dihydro-1H-benzimidazol-1-yl)propyl]sulfanyl}-6-(thiophen-2-yl)-4-(trifluoromethyl)pyridine-3-carbonitrile
Catalog ID
STK033243
SMILES N#Cc1c(SCCCn2c(=O)[nH]c3c2cccc3)nc(cc1C(F)(F)F)c1cccs1
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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 C21H15F3N4OS2 MW 460.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H15F3N4OS2/c22-21(23,24)14-11-16(18-7-3-9-30-18)26-19(13(14)12-25)31-10-4-8-28-17-6-2-1-5-15(17)27-20(28)29/h1-3,5-7,9,11H,4,8,10H2,(H,27,29)InChIKey
KKFGOACKECNDKV-UHFFFAOYSA-NSynonyms
2((3(2OXO23DIHYDRO1HBENZIMIDAZOL1YL)PROPYL)SULFANYL)6(THIOPHEN2YL)4(TRIFLUOROMETHYL)PYRIDINE3CARBONITRILE
2(3(2OXO3HBENZIMIDAZOL1YL)PROPYLSULFANYL)6THIOPHEN2YL4(TRIFLUOROMETHYL)PYRIDINE3CARBONITRILE
C1=CC=C2C(=C1)NC(=O)N2CCCSC3=C(C(=CC(=N3)C4=CC=CS4)C(F)(F)F)C#N
InChI=1SC21H15F3N4OS2c2221(2324)141116(187393018)2619(13(14)1225)3110482817621515(17)2720(28)29h1357911H4810H2(H2729)
MFCD08050370
N#Cc1c(SCCCn2c(=O)(nH)c3c2cccc3)nc(cc1C(F)(F)F)c1cccs1
STK033243
ZINC000009113837
ZINC09113837
ZINC9113837
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