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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H21NO3S/c1-16-13-17(2)15-19(14-16)24-23(26)22(18-7-4-3-5-8-18)27-21(25)11-10-20-9-6-12-28-20/h3-15,22H,1-2H3,(H,24,26)/b11-10+