Vitas-M small molecule compound
ethyl 2-{[N-(3,4-dimethylphenyl)-N-(methylsulfonyl)alanyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STL087478
SMILES CCOC(=O)c1c(sc2c1CCCC2)NC(=O)C(N(S(=O)(=O)C)c1ccc(c(c1)C)C)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 C23H30N2O5S2 MW 478.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H30N2O5S2/c1-6-30-23(27)20-18-9-7-8-10-19(18)31-22(20)24-21(26)16(4)25(32(5,28)29)17-12-11-14(2)15(3)13-17/h11-13,16H,6-10H2,1-5H3,(H,24,26)InChIKey
NXSUJJSYGPEHEJ-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(SC2=C1CCCC2)NC(=O)C(C)N(C3=CC(=C(C=C3)C)C)S(=O)(=O)C
ethyl2((N(34dimethylphenyl)N(methylsulfonyl)alanyl)amino)4567tetrahydro1benzothiophene3carboxylate
ethyl2(2(34dimethylNmethylsulfonylanilino)propanoylamino)4567tetrahydro1benzothiophene3carboxylate
InChI=1SC23H30N2O5S2c163023(27)20189781019(18)3122(20)2421(26)16(4)25(32(528)29)17121114(2)15(3)1317h111316H610H215H3(H2426)
MFCD05837752
ZINC000002879662
ZINC000002879663
Check stock
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Check stock on Vitas-MAvailable files
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