Vitas-M small molecule compound
methyl 2-{[N-(3-methoxyphenyl)-N-(methylsulfonyl)glycyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK946613
SMILES COc1cccc(c1)N(S(=O)(=O)C)CC(=O)Nc1sc2c(c1C(=O)OC)CCCC2
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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 C20H24N2O6S2 MW 452.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H24N2O6S2/c1-27-14-8-6-7-13(11-14)22(30(3,25)26)12-17(23)21-19-18(20(24)28-2)15-9-4-5-10-16(15)29-19/h6-8,11H,4-5,9-10,12H2,1-3H3,(H,21,23)InChIKey
PKPILMXSXFXSGG-UHFFFAOYSA-NSynonyms
COC1=CC=CC(=C1)N(CC(=O)NC2=C(C3=C(S2)CCCC3)C(=O)OC)S(=O)(=O)C
InChI=1SC20H24N2O6S2c1271486713(1114)22(30(325)26)1217(23)211918(20(24)282)159451016(15)2919h6811H4591012H213H3(H2123)
methyl2((2(3methoxyNmethylsulfonylanilino)acetyl)amino)4567tetrahydro1benzothiophene3carboxylate
methyl2((N(3methoxyphenyl)N(methylsulfonyl)glycyl)amino)4567tetrahydro1benzothiophene3carboxylate
MFCD04210377
ZINC000001134508
ZINC01134508
ZINC1134508
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