ethyl 3-methyl-4-[[2-(phenylmethylsulfanyl)phenyl]carbonylamino]benzoate

Systemtic Name: ethyl 3-methyl-4-[[2-(phenylmethylsulfanyl)phenyl]carbonylamino]benzoate Openeye Name: ethyl 4-[(2-benzylsulfanylbenzoyl)amino]-3-methyl-benzoate CAS Name: 3-methyl-4-[[oxo-[2-(phenylmethylthio)phenyl]methyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[(2-benzylsulfanylbenzoyl)amino]-3-methylbenzoate Traditional Name: 4-[[2-(benzylthio)benzoyl]amino]-3-methyl-benzoic acid ethyl ester Formula: C24H23NO3S MolecularWeight: 405.50932

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=C(C=C1)NC(=O)C2=CC=CC=C2SCC3=CC=CC=C3)C

Isomeric SMILES

CCOC(=O)C1=CC(=C(C=C1)NC(=O)C2=CC=CC=C2SCC3=CC=CC=C3)C

InChI

InChI=1S/C24H23NO3S/c1-3-28-24(27)19-13-14-21(17(2)15-19)25-23(26)20-11-7-8-12-22(20)29-16-18-9-5-4-6-10-18/h4-15H,3,16H2,1-2H3,(H,25,26)