ethyl 3-methyl-4-(3-phenylsulfanylpropanoylamino)benzoate

Systemtic Name: ethyl 3-methyl-4-(3-phenylsulfanylpropanoylamino)benzoate Openeye Name: ethyl 3-methyl-4-(3-phenylsulfanylpropanoylamino)benzoate CAS Name: 3-methyl-4-[[1-oxo-3-(phenylthio)propyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 3-methyl-4-(3-phenylsulfanylpropanoylamino)benzoate Traditional Name: 3-methyl-4-[3-(phenylthio)propanoylamino]benzoic acid ethyl ester Formula: C19H21NO3S MolecularWeight: 343.43994

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=C(C=C1)NC(=O)CCSC2=CC=CC=C2)C

Isomeric SMILES

CCOC(=O)C1=CC(=C(C=C1)NC(=O)CCSC2=CC=CC=C2)C

InChI

InChI=1S/C19H21NO3S/c1-3-23-19(22)15-9-10-17(14(2)13-15)20-18(21)11-12-24-16-7-5-4-6-8-16/h4-10,13H,3,11-12H2,1-2H3,(H,20,21)