[2-oxidanylidene-2-(3-phenylsulfanylpropylamino)ethyl] (E)-3-phenylprop-2-enoate

Systemtic Name: [2-oxidanylidene-2-(3-phenylsulfanylpropylamino)ethyl] (E)-3-phenylprop-2-enoate Openeye Name: [2-oxo-2-(3-phenylsulfanylpropylamino)ethyl] (E)-3-phenylprop-2-enoate CAS Name: (E)-3-phenyl-2-propenoic acid [2-oxo-2-[3-(phenylthio)propylamino]ethyl] ester IUPAC Name: [2-oxo-2-(3-phenylsulfanylpropylamino)ethyl] (E)-3-phenylprop-2-enoate Traditional Name: (E)-3-phenylacrylic acid [2-keto-2-[3-(phenylthio)propylamino]ethyl] ester Formula: C20H21NO3S MolecularWeight: 355.45064

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C=CC(=O)OCC(=O)NCCCSC2=CC=CC=C2

Isomeric SMILES

C1=CC=C(C=C1)/C=C/C(=O)OCC(=O)NCCCSC2=CC=CC=C2

InChI

InChI=1S/C20H21NO3S/c22-19(21-14-7-15-25-18-10-5-2-6-11-18)16-24-20(23)13-12-17-8-3-1-4-9-17/h1-6,8-13H,7,14-16H2,(H,21,22)/b13-12+