Vitas-M small molecule compound
ethyl 2-[({3-[(2,2,2-trifluoroethoxy)methyl]phenyl}carbonyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STL172892
SMILES CCOC(=O)c1c(NC(=O)c2cccc(c2)COCC(F)(F)F)sc2c1CCCC2
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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 C21H22F3NO4S MW 441.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22F3NO4S/c1-2-29-20(27)17-15-8-3-4-9-16(15)30-19(17)25-18(26)14-7-5-6-13(10-14)11-28-12-21(22,23)24/h5-7,10H,2-4,8-9,11-12H2,1H3,(H,25,26)InChIKey
VVKIAQNVBPWOMT-UHFFFAOYSA-NSynonyms
445025-77-4445025774
CCOC(=O)C1=C(SC2=C1CCCC2)NC(=O)C3=CC(=CC=C3)COCC(F)(F)F
ethyl2(((3((222trifluoroethoxy)methyl)phenyl)carbonyl)amino)4567tetrahydro1benzothiophene3carboxylate
ethyl2((3(222trifluoroethoxymethyl)benzoyl)amino)4567tetrahydro1benzothiophene3carboxylate
InChI=1SC21H22F3NO4Sc122920(27)1715834916(15)3019(17)2518(26)1475613(1014)11281221(2223)24h5710H24891112H21H3(H2526)
MFCD02056578
ZINC000000648206
ZINC00648206
ZINC648206
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