Vitas-M small molecule compound
methyl 2-({1,1,1,3,3,3-hexafluoro-2-[(phenylcarbonyl)amino]propan-2-yl}amino)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate
Catalog ID
STK535796
SMILES COC(=O)c1c(sc2c1CCCCC2)NC(C(F)(F)F)(C(F)(F)F)NC(=O)c1ccccc1
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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 C21H20F6N2O3S MW 494.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20F6N2O3S/c1-32-18(31)15-13-10-6-3-7-11-14(13)33-17(15)29-19(20(22,23)24,21(25,26)27)28-16(30)12-8-4-2-5-9-12/h2,4-5,8-9,29H,3,6-7,10-11H2,1H3,(H,28,30)InChIKey
SWMPBHIIFBCHGG-UHFFFAOYSA-NSynonyms
374549-49-2374549492
COC(=O)C1=C(SC2=C1CCCCC2)NC(C(F)(F)F)(C(F)(F)F)NC(=O)C3=CC=CC=C3
InChI=1SC21H20F6N2O3Sc13218(31)1513106371114(13)3317(15)2919(20(2223)2421(2526)27)2816(30)128425912h2458929H3671011H21H3(H2830)
methyl2((111333hexafluoro2((phenylcarbonyl)amino)propan2yl)amino)5678tetrahydro4Hcyclohepta(b)thiophene3carboxylate
methyl2((2benzamido111333hexafluoropropan2yl)amino)5678tetrahydro4Hcyclohepta(b)thiophene3carboxylate
MFCD01957233
ZINC000009339714
ZINC09339714
ZINC9339714
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