[2-oxidanylidene-2-[[2-(phenylmethyl)phenyl]amino]ethyl] 3-thiophen-3-ylpropanoate

Systemtic Name: [2-oxidanylidene-2-[[2-(phenylmethyl)phenyl]amino]ethyl] 3-thiophen-3-ylpropanoate Openeye Name: [2-(2-benzylanilino)-2-oxo-ethyl] 3-(3-thienyl)propanoate CAS Name: 3-(3-thiophenyl)propanoic acid [2-oxo-2-[2-(phenylmethyl)anilino]ethyl] ester IUPAC Name: [2-(2-benzylanilino)-2-oxoethyl] 3-thiophen-3-ylpropanoate Traditional Name: 3-(3-thienyl)propionic acid [2-(2-benzylanilino)-2-keto-ethyl] ester Formula: C22H21NO3S MolecularWeight: 379.47204

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=CC=CC=C2NC(=O)COC(=O)CCC3=CSC=C3

Isomeric SMILES

C1=CC=C(C=C1)CC2=CC=CC=C2NC(=O)COC(=O)CCC3=CSC=C3

InChI

InChI=1S/C22H21NO3S/c24-21(15-26-22(25)11-10-18-12-13-27-16-18)23-20-9-5-4-8-19(20)14-17-6-2-1-3-7-17/h1-9,12-13,16H,10-11,14-15H2,(H,23,24)