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

Systemtic Name: [3-[[propan-2-yl(2-thiophen-2-ylethanoyl)amino]methyl]phenyl] methanesulfonate Openeye Name: [3-[[isopropyl-[2-(2-thienyl)acetyl]amino]methyl]phenyl] methanesulfonate CAS Name: methanesulfonic acid [3-[[(1-oxo-2-thiophen-2-ylethyl)-propan-2-ylamino]methyl]phenyl] ester IUPAC Name: [3-[[propan-2-yl-(2-thiophen-2-ylacetyl)amino]methyl]phenyl] methanesulfonate Traditional Name: methanesulfonic acid [3-[[isopropyl-[2-(2-thienyl)acetyl]amino]methyl]phenyl] ester Formula: C17H21NO4S2 MolecularWeight: 367.48294

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H21NO4S2/c1-13(2)18(17(19)11-16-8-5-9-23-16)12-14-6-4-7-15(10-14)22-24(3,20)21/h4-10,13H,11-12H2,1-3H3