(4-oxidanylidene-4-thiophen-2-yl-butyl) 2-[(2-cyanophenyl)sulfonylamino]ethanoate

Systemtic Name: (4-oxidanylidene-4-thiophen-2-yl-butyl) 2-[(2-cyanophenyl)sulfonylamino]ethanoate Openeye Name: [4-oxo-4-(2-thienyl)butyl] 2-[(2-cyanophenyl)sulfonylamino]acetate CAS Name: 2-[(2-cyanophenyl)sulfonylamino]acetic acid (4-oxo-4-thiophen-2-ylbutyl) ester IUPAC Name: (4-oxo-4-thiophen-2-ylbutyl) 2-[(2-cyanophenyl)sulfonylamino]acetate Traditional Name: 2-[(2-cyanophenyl)sulfonylamino]acetic acid [4-keto-4-(2-thienyl)butyl] ester Formula: C17H16N2O5S2 MolecularWeight: 392.44934

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H16N2O5S2/c18-11-13-5-1-2-8-16(13)26(22,23)19-12-17(21)24-9-3-6-14(20)15-7-4-10-25-15/h1-2,4-5,7-8,10,19H,3,6,9,12H2