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

Systemtic Name: methyl 4-[[[2-(thiophen-2-ylmethylsulfanyl)phenyl]carbonylamino]methyl]benzoate Openeye Name: methyl 4-[[[2-(2-thienylmethylsulfanyl)benzoyl]amino]methyl]benzoate CAS Name: 4-[[[oxo-[2-(thiophen-2-ylmethylthio)phenyl]methyl]amino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[[2-(thiophen-2-ylmethylsulfanyl)benzoyl]amino]methyl]benzoate Traditional Name: 4-[[[2-(2-thenylthio)benzoyl]amino]methyl]benzoic acid methyl ester Formula: C21H19NO3S2 MolecularWeight: 397.51046

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H19NO3S2/c1-25-21(24)16-10-8-15(9-11-16)13-22-20(23)18-6-2-3-7-19(18)27-14-17-5-4-12-26-17/h2-12H,13-14H2,1H3,(H,22,23)