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

Systemtic Name: [2-oxidanylidene-2-(3-phenylsulfanylpropylamino)ethyl] (E)-3-thiophen-2-ylprop-2-enoate Openeye Name: [2-oxo-2-(3-phenylsulfanylpropylamino)ethyl] (E)-3-(2-thienyl)prop-2-enoate CAS Name: (E)-3-thiophen-2-yl-2-propenoic acid [2-oxo-2-[3-(phenylthio)propylamino]ethyl] ester IUPAC Name: [2-oxo-2-(3-phenylsulfanylpropylamino)ethyl] (E)-3-thiophen-2-ylprop-2-enoate Traditional Name: (E)-3-(2-thienyl)acrylic acid [2-keto-2-[3-(phenylthio)propylamino]ethyl] ester Formula: C18H19NO3S2 MolecularWeight: 361.47836

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SCCCNC(=O)COC(=O)C=CC2=CC=CS2

Isomeric SMILES

C1=CC=C(C=C1)SCCCNC(=O)COC(=O)/C=C/C2=CC=CS2

InChI

InChI=1S/C18H19NO3S2/c20-17(14-22-18(21)10-9-16-8-4-12-23-16)19-11-5-13-24-15-6-2-1-3-7-15/h1-4,6-10,12H,5,11,13-14H2,(H,19,20)/b10-9+