Vitas-M small molecule compound
ethyl 6-ethyl-2-[(3-phenylpropanoyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK426640
SMILES CCOC(=O)c1c(NC(=O)CCc2ccccc2)sc2c1CCC(C2)CC
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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 C22H27NO3S MW 385.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H27NO3S/c1-3-15-10-12-17-18(14-15)27-21(20(17)22(25)26-4-2)23-19(24)13-11-16-8-6-5-7-9-16/h5-9,15H,3-4,10-14H2,1-2H3,(H,23,24)InChIKey
NESSWVWVNUKTKX-UHFFFAOYSA-NSynonyms
CCC1CCC2=C(C1)SC(=C2C(=O)OCC)NC(=O)CCC3=CC=CC=C3
ethyl6ethyl2((3phenylpropanoyl)amino)4567tetrahydro1benzothiophene3carboxylate
ethyl6ethyl2(3phenylpropanoylamino)4567tetrahydro1benzothiophene3carboxylate
InChI=1SC22H27NO3Sc131510121718(1415)2721(20(17)22(25)2642)2319(24)1311168657916h5915H341014H212H3(H2324)
MFCD01355282
ZINC000002741681
ZINC000002741682
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