Vitas-M small molecule compound
ethyl 2-{[2-(4-chloro-2-methylphenoxy)propanoyl]amino}-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK426767
SMILES CCOC(=O)c1c(NC(=O)C(Oc2ccc(cc2C)Cl)C)sc2c1CCC(C2)C
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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 C22H26ClNO4S MW 435.97 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H26ClNO4S/c1-5-27-22(26)19-16-8-6-12(2)10-18(16)29-21(19)24-20(25)14(4)28-17-9-7-15(23)11-13(17)3/h7,9,11-12,14H,5-6,8,10H2,1-4H3,(H,24,25)InChIKey
FLCJIRPEVLQBGX-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(SC2=C1CCC(C2)C)NC(=O)C(C)OC3=C(C=C(C=C3)Cl)C
ethyl2((2(4chloro2methylphenoxy)propanoyl)amino)6methyl4567tetrahydro1benzothiophene3carboxylate
ethyl2(2(4chloro2methylphenoxy)propanoylamino)6methyl4567tetrahydro1benzothiophene3carboxylate
InChI=1SC22H26ClNO4Sc152722(26)19168612(2)1018(16)2921(19)2420(25)14(4)28179715(23)1113(17)3h79111214H56810H214H3(H2425)
MFCD01358688
ZINC000001940226
ZINC000001940229
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