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

Systemtic Name: [2-oxidanylidene-2-[(2-phenylsulfanylphenyl)amino]ethyl] (E)-3-thiophen-3-ylprop-2-enoate Openeye Name: [2-oxo-2-(2-phenylsulfanylanilino)ethyl] (E)-3-(3-thienyl)prop-2-enoate CAS Name: (E)-3-(3-thiophenyl)-2-propenoic acid [2-oxo-2-[2-(phenylthio)anilino]ethyl] ester IUPAC Name: [2-oxo-2-(2-phenylsulfanylanilino)ethyl] (E)-3-thiophen-3-ylprop-2-enoate Traditional Name: (E)-3-(3-thienyl)acrylic acid [2-keto-2-[2-(phenylthio)anilino]ethyl] ester Formula: C21H17NO3S2 MolecularWeight: 395.49458

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SC2=CC=CC=C2NC(=O)COC(=O)C=CC3=CSC=C3

Isomeric SMILES

C1=CC=C(C=C1)SC2=CC=CC=C2NC(=O)COC(=O)/C=C/C3=CSC=C3

InChI

InChI=1S/C21H17NO3S2/c23-20(14-25-21(24)11-10-16-12-13-26-15-16)22-18-8-4-5-9-19(18)27-17-6-2-1-3-7-17/h1-13,15H,14H2,(H,22,23)/b11-10+