[2-[(2,5-dimethoxyphenyl)amino]-2-oxidanylidene-ethyl] 3-(4-fluorophenyl)-2-thiophen-2-yl-prop-2-enoate

Systemtic Name: [2-[(2,5-dimethoxyphenyl)amino]-2-oxidanylidene-ethyl] 3-(4-fluorophenyl)-2-thiophen-2-yl-prop-2-enoate Openeye Name: [2-(2,5-dimethoxyanilino)-2-oxo-ethyl] 3-(4-fluorophenyl)-2-(2-thienyl)prop-2-enoate CAS Name: 3-(4-fluorophenyl)-2-thiophen-2-yl-2-propenoic acid [2-(2,5-dimethoxyanilino)-2-oxoethyl] ester IUPAC Name: [2-(2,5-dimethoxyanilino)-2-oxoethyl] 3-(4-fluorophenyl)-2-thiophen-2-ylprop-2-enoate Traditional Name: 3-(4-fluorophenyl)-2-(2-thienyl)acrylic acid [2-(2,5-dimethoxyanilino)-2-keto-ethyl] ester Formula: C23H20FNO5S MolecularWeight: 441.472003

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)NC(=O)COC(=O)C(=CC2=CC=C(C=C2)F)C3=CC=CS3

Isomeric SMILES

COC1=CC(=C(C=C1)OC)NC(=O)COC(=O)C(=CC2=CC=C(C=C2)F)C3=CC=CS3

InChI

InChI=1S/C23H20FNO5S/c1-28-17-9-10-20(29-2)19(13-17)25-22(26)14-30-23(27)18(21-4-3-11-31-21)12-15-5-7-16(24)8-6-15/h3-13H,14H2,1-2H3,(H,25,26)