Vitas-M small molecule compound
methyl 6-ethyl-2-{[(2E)-3-(4-methylphenyl)prop-2-enoyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK418907
SMILES CCC1CCc2c(C1)sc(c2C(=O)OC)NC(=O)/C=C/c1ccc(cc1)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 C22H25NO3S MW 383.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H25NO3S/c1-4-15-9-11-17-18(13-15)27-21(20(17)22(25)26-3)23-19(24)12-10-16-7-5-14(2)6-8-16/h5-8,10,12,15H,4,9,11,13H2,1-3H3,(H,23,24)/b12-10+InChIKey
MSSXBLKWTKXILQ-ZRDIBKRKSA-NSynonyms
CCC1CCC2=C(C1)SC(=C2C(=O)OC)NC(=O)C=CC3=CC=C(C=C3)C
CCC1CCc2c(C1)sc(c2C(=O)OC)NC(=O)C=Cc1ccc(cc1)C
InChI=1SC22H25NO3Sc14159111718(1315)2721(20(17)22(25)263)2319(24)1210167514(2)6816h58101215H491113H213H3(H2324)b1210+
methyl6ethyl2(((2E)3(4methylphenyl)prop2enoyl)amino)4567tetrahydro1benzothiophene3carboxylate
methyl6ethyl2(((E)3(4methylphenyl)prop2enoyl)amino)4567tetrahydro1benzothiophene3carboxylate
MFCD01344619
ZINC000002737294
ZINC000002737296
Check stock
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Check stock on Vitas-MAvailable files
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