methyl 3-[(5-tert-butyl-2-methyl-phenyl)sulfonylamino]-3-thiophen-2-yl-propanoate

Systemtic Name: methyl 3-[(5-tert-butyl-2-methyl-phenyl)sulfonylamino]-3-thiophen-2-yl-propanoate Openeye Name: methyl 3-[(5-tert-butyl-2-methyl-phenyl)sulfonylamino]-3-(2-thienyl)propanoate CAS Name: 3-[(5-tert-butyl-2-methylphenyl)sulfonylamino]-3-thiophen-2-ylpropanoic acid methyl ester IUPAC Name: methyl 3-[(5-tert-butyl-2-methylphenyl)sulfonylamino]-3-thiophen-2-ylpropanoate Traditional Name: 3-[(5-tert-butyl-2-methyl-phenyl)sulfonylamino]-3-(2-thienyl)propionic acid methyl ester Formula: C19H25NO4S2 MolecularWeight: 395.5361

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(C)(C)C)S(=O)(=O)NC(CC(=O)OC)C2=CC=CS2

Isomeric SMILES

CC1=C(C=C(C=C1)C(C)(C)C)S(=O)(=O)NC(CC(=O)OC)C2=CC=CS2

InChI

InChI=1S/C19H25NO4S2/c1-13-8-9-14(19(2,3)4)11-17(13)26(22,23)20-15(12-18(21)24-5)16-7-6-10-25-16/h6-11,15,20H,12H2,1-5H3