methyl 2-[[4-[[2-(thiophen-2-ylmethylsulfanyl)phenyl]carbonylamino]phenyl]carbonylamino]ethanoate

Systemtic Name: methyl 2-[[4-[[2-(thiophen-2-ylmethylsulfanyl)phenyl]carbonylamino]phenyl]carbonylamino]ethanoate Openeye Name: methyl 2-[[4-[[2-(2-thienylmethylsulfanyl)benzoyl]amino]benzoyl]amino]acetate CAS Name: 2-[[oxo-[4-[[oxo-[2-(thiophen-2-ylmethylthio)phenyl]methyl]amino]phenyl]methyl]amino]acetic acid methyl ester IUPAC Name: methyl 2-[[4-[[2-(thiophen-2-ylmethylsulfanyl)benzoyl]amino]benzoyl]amino]acetate Traditional Name: 2-[[4-[[2-(2-thenylthio)benzoyl]amino]benzoyl]amino]acetic acid methyl ester Formula: C22H20N2O4S2 MolecularWeight: 440.5352

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CNC(=O)C1=CC=C(C=C1)NC(=O)C2=CC=CC=C2SCC3=CC=CS3

Isomeric SMILES

COC(=O)CNC(=O)C1=CC=C(C=C1)NC(=O)C2=CC=CC=C2SCC3=CC=CS3

InChI

InChI=1S/C22H20N2O4S2/c1-28-20(25)13-23-21(26)15-8-10-16(11-9-15)24-22(27)18-6-2-3-7-19(18)30-14-17-5-4-12-29-17/h2-12H,13-14H2,1H3,(H,23,26)(H,24,27)