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

Systemtic Name: methyl 4-[2-[[2-(2-cyanophenyl)sulfanylphenyl]carbonylamino]ethyl]benzoate Openeye Name: methyl 4-[2-[[2-(2-cyanophenyl)sulfanylbenzoyl]amino]ethyl]benzoate CAS Name: 4-[2-[[[2-[(2-cyanophenyl)thio]phenyl]-oxomethyl]amino]ethyl]benzoic acid methyl ester IUPAC Name: methyl 4-[2-[[2-(2-cyanophenyl)sulfanylbenzoyl]amino]ethyl]benzoate Traditional Name: 4-[2-[[2-[(2-cyanophenyl)thio]benzoyl]amino]ethyl]benzoic acid methyl ester Formula: C24H20N2O3S MolecularWeight: 416.4922

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CCNC(=O)C2=CC=CC=C2SC3=CC=CC=C3C#N

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CCNC(=O)C2=CC=CC=C2SC3=CC=CC=C3C#N

InChI

InChI=1S/C24H20N2O3S/c1-29-24(28)18-12-10-17(11-13-18)14-15-26-23(27)20-7-3-5-9-22(20)30-21-8-4-2-6-19(21)16-25/h2-13H,14-15H2,1H3,(H,26,27)