[2-oxidanylidene-2-[(3-piperidin-1-ylsulfonylphenyl)amino]ethyl] (E)-3-thiophen-2-ylprop-2-enoate

Systemtic Name: [2-oxidanylidene-2-[(3-piperidin-1-ylsulfonylphenyl)amino]ethyl] (E)-3-thiophen-2-ylprop-2-enoate Openeye Name: [2-oxo-2-[3-(1-piperidylsulfonyl)anilino]ethyl] (E)-3-(2-thienyl)prop-2-enoate CAS Name: (E)-3-thiophen-2-yl-2-propenoic acid [2-oxo-2-[3-(1-piperidinylsulfonyl)anilino]ethyl] ester IUPAC Name: [2-oxo-2-(3-piperidin-1-ylsulfonylanilino)ethyl] (E)-3-thiophen-2-ylprop-2-enoate Traditional Name: (E)-3-(2-thienyl)acrylic acid [2-keto-2-(3-piperidinosulfonylanilino)ethyl] ester Formula: C20H22N2O5S2 MolecularWeight: 434.52908

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)NC(=O)COC(=O)C=CC3=CC=CS3

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)NC(=O)COC(=O)/C=C/C3=CC=CS3

InChI

InChI=1S/C20H22N2O5S2/c23-19(15-27-20(24)10-9-17-7-5-13-28-17)21-16-6-4-8-18(14-16)29(25,26)22-11-2-1-3-12-22/h4-10,13-14H,1-3,11-12,15H2,(H,21,23)/b10-9+