Vitas-M small molecule compound
(2E)-4,4,4-trifluoro-3-[(1-methyl-1H-benzimidazol-2-yl)amino]-1-(thiophen-2-yl)but-2-en-1-one
Catalog ID
STK047838
SMILES O=C(c1cccs1)/C=C(\C(F)(F)F)/Nc1nc2c(n1C)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 C16H12F3N3OS MW 351.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H12F3N3OS/c1-22-11-6-3-2-5-10(11)20-15(22)21-14(16(17,18)19)9-12(23)13-7-4-8-24-13/h2-9H,1H3,(H,20,21)/b14-9+InChIKey
VSNXLJFGRKZERO-NTEUORMPSA-NSynonyms
(2E)444TRIFLUORO3((1METHYL1HBENZIMIDAZOL2YL)AMINO)1(THIOPHEN2YL)BUT2EN1ONE
(E)444TRIFLUORO3((1METHYLBENZIMIDAZOL2YL)AMINO)1THIOPHEN2YLBUT2EN1ONE
CN1C2=CC=CC=C2N=C1NC(=CC(=O)C3=CC=CS3)C(F)(F)F
InChI=1SC16H12F3N3OSc12211632510(11)2015(22)2114(16(1718)19)912(23)137482413h29H1H3(H2021)b149+
MFCD06019330
O=C(c1cccs1)C=C(C(F)(F)F)Nc1nc2c(n1C)cccc2
STK047838
ZINC000018106056
ZINC18106056
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