(4-oxidanylidene-4-thiophen-2-yl-butyl) 2-[(3,4-dimethylphenyl)sulfonylamino]ethanoate

Systemtic Name: (4-oxidanylidene-4-thiophen-2-yl-butyl) 2-[(3,4-dimethylphenyl)sulfonylamino]ethanoate Openeye Name: [4-oxo-4-(2-thienyl)butyl] 2-[(3,4-dimethylphenyl)sulfonylamino]acetate CAS Name: 2-[(3,4-dimethylphenyl)sulfonylamino]acetic acid (4-oxo-4-thiophen-2-ylbutyl) ester IUPAC Name: (4-oxo-4-thiophen-2-ylbutyl) 2-[(3,4-dimethylphenyl)sulfonylamino]acetate Traditional Name: 2-[(3,4-dimethylphenyl)sulfonylamino]acetic acid [4-keto-4-(2-thienyl)butyl] ester Formula: C18H21NO5S2 MolecularWeight: 395.49304

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)NCC(=O)OCCCC(=O)C2=CC=CS2)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)NCC(=O)OCCCC(=O)C2=CC=CS2)C

InChI

InChI=1S/C18H21NO5S2/c1-13-7-8-15(11-14(13)2)26(22,23)19-12-18(21)24-9-3-5-16(20)17-6-4-10-25-17/h4,6-8,10-11,19H,3,5,9,12H2,1-2H3