[2-[(3-cyanothiophen-2-yl)amino]-2-oxidanylidene-ethyl] 2-[(4-cyanophenyl)sulfonylamino]ethanoate

Systemtic Name: [2-[(3-cyanothiophen-2-yl)amino]-2-oxidanylidene-ethyl] 2-[(4-cyanophenyl)sulfonylamino]ethanoate Openeye Name: [2-[(3-cyano-2-thienyl)amino]-2-oxo-ethyl] 2-[(4-cyanophenyl)sulfonylamino]acetate CAS Name: 2-[(4-cyanophenyl)sulfonylamino]acetic acid [2-[(3-cyano-2-thiophenyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[(3-cyanothiophen-2-yl)amino]-2-oxoethyl] 2-[(4-cyanophenyl)sulfonylamino]acetate Traditional Name: 2-[(4-cyanophenyl)sulfonylamino]acetic acid [2-[(3-cyano-2-thienyl)amino]-2-keto-ethyl] ester Formula: C16H12N4O5S2 MolecularWeight: 404.42028

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C#N)S(=O)(=O)NCC(=O)OCC(=O)NC2=C(C=CS2)C#N

Isomeric SMILES

C1=CC(=CC=C1C#N)S(=O)(=O)NCC(=O)OCC(=O)NC2=C(C=CS2)C#N

InChI

InChI=1S/C16H12N4O5S2/c17-7-11-1-3-13(4-2-11)27(23,24)19-9-15(22)25-10-14(21)20-16-12(8-18)5-6-26-16/h1-6,19H,9-10H2,(H,20,21)