[5-[[cyclopropyl(thiophen-2-ylcarbonyl)amino]methyl]-2-methoxy-phenyl] propane-2-sulfonate

Systemtic Name: [5-[[cyclopropyl(thiophen-2-ylcarbonyl)amino]methyl]-2-methoxy-phenyl] propane-2-sulfonate Openeye Name: [5-[[cyclopropyl(thiophene-2-carbonyl)amino]methyl]-2-methoxy-phenyl] propane-2-sulfonate CAS Name: 2-propanesulfonic acid IUPAC Name: [5-[[cyclopropyl(thiophene-2-carbonyl)amino]methyl]-2-methoxyphenyl] propane-2-sulfonate Traditional Name: propane-2-sulfonic acid [5-[[cyclopropyl(2-thenoyl)amino]methyl]-2-methoxy-phenyl] ester Formula: C19H23NO5S2 MolecularWeight: 409.51962

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)S(=O)(=O)OC1=C(C=CC(=C1)CN(C2CC2)C(=O)C3=CC=CS3)OC

Isomeric SMILES

CC(C)S(=O)(=O)OC1=C(C=CC(=C1)CN(C2CC2)C(=O)C3=CC=CS3)OC

InChI

InChI=1S/C19H23NO5S2/c1-13(2)27(22,23)25-17-11-14(6-9-16(17)24-3)12-20(15-7-8-15)19(21)18-5-4-10-26-18/h4-6,9-11,13,15H,7-8,12H2,1-3H3