[1-[(4-cyanophenyl)amino]-1-oxidanylidene-propan-2-yl] 2-[(4-fluorophenyl)sulfonylamino]propanoate

Systemtic Name: [1-[(4-cyanophenyl)amino]-1-oxidanylidene-propan-2-yl] 2-[(4-fluorophenyl)sulfonylamino]propanoate Openeye Name: [2-(4-cyanoanilino)-1-methyl-2-oxo-ethyl] 2-[(4-fluorophenyl)sulfonylamino]propanoate CAS Name: 2-[(4-fluorophenyl)sulfonylamino]propanoic acid [1-(4-cyanoanilino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(4-cyanoanilino)-1-oxopropan-2-yl] 2-[(4-fluorophenyl)sulfonylamino]propanoate Traditional Name: 2-[(4-fluorophenyl)sulfonylamino]propionic acid [2-(4-cyanoanilino)-2-keto-1-methyl-ethyl] ester Formula: C19H18FN3O5S MolecularWeight: 419.426723

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OC(C)C(=O)NC1=CC=C(C=C1)C#N)NS(=O)(=O)C2=CC=C(C=C2)F

Isomeric SMILES

CC(C(=O)OC(C)C(=O)NC1=CC=C(C=C1)C#N)NS(=O)(=O)C2=CC=C(C=C2)F

InChI

InChI=1S/C19H18FN3O5S/c1-12(23-29(26,27)17-9-5-15(20)6-10-17)19(25)28-13(2)18(24)22-16-7-3-14(11-21)4-8-16/h3-10,12-13,23H,1-2H3,(H,22,24)