[2-[(2,5-dimethylphenyl)amino]-2-oxidanylidene-1-phenyl-ethyl] (E)-3-thiophen-2-ylprop-2-enoate

Systemtic Name: [2-[(2,5-dimethylphenyl)amino]-2-oxidanylidene-1-phenyl-ethyl] (E)-3-thiophen-2-ylprop-2-enoate Openeye Name: [2-(2,5-dimethylanilino)-2-oxo-1-phenyl-ethyl] (E)-3-(2-thienyl)prop-2-enoate CAS Name: (E)-3-thiophen-2-yl-2-propenoic acid [2-(2,5-dimethylanilino)-2-oxo-1-phenylethyl] ester IUPAC Name: [2-(2,5-dimethylanilino)-2-oxo-1-phenylethyl] (E)-3-thiophen-2-ylprop-2-enoate Traditional Name: (E)-3-(2-thienyl)acrylic acid [2-(2,5-dimethylanilino)-2-keto-1-phenyl-ethyl] ester Formula: C23H21NO3S MolecularWeight: 391.48274

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)NC(=O)C(C2=CC=CC=C2)OC(=O)C=CC3=CC=CS3

Isomeric SMILES

CC1=CC(=C(C=C1)C)NC(=O)C(C2=CC=CC=C2)OC(=O)/C=C/C3=CC=CS3

InChI

InChI=1S/C23H21NO3S/c1-16-10-11-17(2)20(15-16)24-23(26)22(18-7-4-3-5-8-18)27-21(25)13-12-19-9-6-14-28-19/h3-15,22H,1-2H3,(H,24,26)/b13-12+