[2-oxidanylidene-2-[(2-phenylsulfanylphenyl)amino]ethyl] (E)-3-(1,3-benzoxazol-2-yl)prop-2-enoate

Systemtic Name: [2-oxidanylidene-2-[(2-phenylsulfanylphenyl)amino]ethyl] (E)-3-(1,3-benzoxazol-2-yl)prop-2-enoate Openeye Name: [2-oxo-2-(2-phenylsulfanylanilino)ethyl] (E)-3-(1,3-benzoxazol-2-yl)prop-2-enoate CAS Name: (E)-3-(1,3-benzoxazol-2-yl)-2-propenoic acid [2-oxo-2-[2-(phenylthio)anilino]ethyl] ester IUPAC Name: [2-oxo-2-(2-phenylsulfanylanilino)ethyl] (E)-3-(1,3-benzoxazol-2-yl)prop-2-enoate Traditional Name: (E)-3-(1,3-benzoxazol-2-yl)acrylic acid [2-keto-2-[2-(phenylthio)anilino]ethyl] ester Formula: C24H18N2O4S MolecularWeight: 430.47572

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SC2=CC=CC=C2NC(=O)COC(=O)C=CC3=NC4=CC=CC=C4O3

Isomeric SMILES

C1=CC=C(C=C1)SC2=CC=CC=C2NC(=O)COC(=O)/C=C/C3=NC4=CC=CC=C4O3

InChI

InChI=1S/C24H18N2O4S/c27-22(25-19-11-5-7-13-21(19)31-17-8-2-1-3-9-17)16-29-24(28)15-14-23-26-18-10-4-6-12-20(18)30-23/h1-15H,16H2,(H,25,27)/b15-14+