ethyl 4-[[2-(2-cyanophenyl)sulfanylphenyl]carbonylamino]benzoate

Systemtic Name: ethyl 4-[[2-(2-cyanophenyl)sulfanylphenyl]carbonylamino]benzoate Openeye Name: ethyl 4-[[2-(2-cyanophenyl)sulfanylbenzoyl]amino]benzoate CAS Name: 4-[[[2-[(2-cyanophenyl)thio]phenyl]-oxomethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[2-(2-cyanophenyl)sulfanylbenzoyl]amino]benzoate Traditional Name: 4-[[2-[(2-cyanophenyl)thio]benzoyl]amino]benzoic acid ethyl ester Formula: C23H18N2O3S MolecularWeight: 402.46562

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)C2=CC=CC=C2SC3=CC=CC=C3C#N

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)C2=CC=CC=C2SC3=CC=CC=C3C#N

InChI

InChI=1S/C23H18N2O3S/c1-2-28-23(27)16-11-13-18(14-12-16)25-22(26)19-8-4-6-10-21(19)29-20-9-5-3-7-17(20)15-24/h3-14H,2H2,1H3,(H,25,26)