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

Systemtic Name: [2-oxidanylidene-2-[(phenylmethyl)amino]ethyl] 3-(4-fluorophenyl)-2-thiophen-2-yl-prop-2-enoate Openeye Name: [2-(benzylamino)-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-oxo-2-[(phenylmethyl)amino]ethyl] ester IUPAC Name: [2-(benzylamino)-2-oxoethyl] 3-(4-fluorophenyl)-2-thiophen-2-ylprop-2-enoate Traditional Name: 3-(4-fluorophenyl)-2-(2-thienyl)acrylic acid [2-(benzylamino)-2-keto-ethyl] ester Formula: C22H18FNO3S MolecularWeight: 395.446623

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=O)COC(=O)C(=CC2=CC=C(C=C2)F)C3=CC=CS3

Isomeric SMILES

C1=CC=C(C=C1)CNC(=O)COC(=O)C(=CC2=CC=C(C=C2)F)C3=CC=CS3

InChI

InChI=1S/C22H18FNO3S/c23-18-10-8-16(9-11-18)13-19(20-7-4-12-28-20)22(26)27-15-21(25)24-14-17-5-2-1-3-6-17/h1-13H,14-15H2,(H,24,25)