ethyl 2-methyl-3-(2-phenylsulfanylpropanoylamino)benzoate

Systemtic Name: ethyl 2-methyl-3-(2-phenylsulfanylpropanoylamino)benzoate Openeye Name: ethyl 2-methyl-3-(2-phenylsulfanylpropanoylamino)benzoate CAS Name: 2-methyl-3-[[1-oxo-2-(phenylthio)propyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 2-methyl-3-(2-phenylsulfanylpropanoylamino)benzoate Traditional Name: 2-methyl-3-[2-(phenylthio)propanoylamino]benzoic acid ethyl ester Formula: C19H21NO3S MolecularWeight: 343.43994

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=CC=C1)NC(=O)C(C)SC2=CC=CC=C2)C

Isomeric SMILES

CCOC(=O)C1=C(C(=CC=C1)NC(=O)C(C)SC2=CC=CC=C2)C

InChI

InChI=1S/C19H21NO3S/c1-4-23-19(22)16-11-8-12-17(13(16)2)20-18(21)14(3)24-15-9-6-5-7-10-15/h5-12,14H,4H2,1-3H3,(H,20,21)