[2-methoxy-5-[[propan-2-yl(2-thiophen-2-ylethanoyl)amino]methyl]phenyl] methanesulfonate

Systemtic Name: [2-methoxy-5-[[propan-2-yl(2-thiophen-2-ylethanoyl)amino]methyl]phenyl] methanesulfonate Openeye Name: [5-[[isopropyl-[2-(2-thienyl)acetyl]amino]methyl]-2-methoxy-phenyl] methanesulfonate CAS Name: methanesulfonic acid [2-methoxy-5-[[(1-oxo-2-thiophen-2-ylethyl)-propan-2-ylamino]methyl]phenyl] ester IUPAC Name: [2-methoxy-5-[[propan-2-yl-(2-thiophen-2-ylacetyl)amino]methyl]phenyl] methanesulfonate Traditional Name: methanesulfonic acid [5-[[isopropyl-[2-(2-thienyl)acetyl]amino]methyl]-2-methoxy-phenyl] ester Formula: C18H23NO5S2 MolecularWeight: 397.50892

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(CC1=CC(=C(C=C1)OC)OS(=O)(=O)C)C(=O)CC2=CC=CS2

Isomeric SMILES

CC(C)N(CC1=CC(=C(C=C1)OC)OS(=O)(=O)C)C(=O)CC2=CC=CS2

InChI

InChI=1S/C18H23NO5S2/c1-13(2)19(18(20)11-15-6-5-9-25-15)12-14-7-8-16(23-3)17(10-14)24-26(4,21)22/h5-10,13H,11-12H2,1-4H3