Vitas-M small molecule compound
methyl 2-({1,1,1,3,3,3-hexafluoro-2-[(phenylacetyl)amino]propan-2-yl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK786776
SMILES COC(=O)c1c(sc2c1CCCC2)NC(C(F)(F)F)(C(F)(F)F)NC(=O)Cc1ccccc1
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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)16-13-9-5-6-10-14(13)33-17(16)29-19(20(22,23)24,21(25,26)27)28-15(30)11-12-7-3-2-4-8-12/h2-4,7-8,29H,5-6,9-11H2,1H3,(H,28,30)InChIKey
OFYNQDFUHAMBPL-UHFFFAOYSA-NSynonyms
488731-04-0488731040
COC(=O)C1=C(SC2=C1CCCC2)NC(C(F)(F)F)(C(F)(F)F)NC(=O)CC3=CC=CC=C3
InChI=1SC21H20F6N2O3Sc13218(31)16139561014(13)3317(16)2919(20(2223)2421(2526)27)2815(30)11127324812h247829H56911H21H3(H2830)
methyl2((111333hexafluoro2((2phenylacetyl)amino)propan2yl)amino)4567tetrahydro1benzothiophene3carboxylate
methyl2((111333hexafluoro2((phenylacetyl)amino)propan2yl)amino)4567tetrahydro1benzothiophene3carboxylate
methyl2((111333hexafluoro2(2phenylacetamido)propan2yl)amino)4567tetrahydrobenzo(b)thiophene3carboxylate
MFCD03291723
ZINC000012417736
ZINC12417736
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