methyl 4-[2-(3,4-dimethoxyphenyl)sulfanylpropanoylamino]benzoate

Systemtic Name: methyl 4-[2-(3,4-dimethoxyphenyl)sulfanylpropanoylamino]benzoate Openeye Name: methyl 4-[2-(3,4-dimethoxyphenyl)sulfanylpropanoylamino]benzoate CAS Name: 4-[[2-[(3,4-dimethoxyphenyl)thio]-1-oxopropyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[2-(3,4-dimethoxyphenyl)sulfanylpropanoylamino]benzoate Traditional Name: 4-[2-[(3,4-dimethoxyphenyl)thio]propanoylamino]benzoic acid methyl ester Formula: C19H21NO5S MolecularWeight: 375.43874

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)C(=O)OC)SC2=CC(=C(C=C2)OC)OC

Isomeric SMILES

CC(C(=O)NC1=CC=C(C=C1)C(=O)OC)SC2=CC(=C(C=C2)OC)OC

InChI

InChI=1S/C19H21NO5S/c1-12(26-15-9-10-16(23-2)17(11-15)24-3)18(21)20-14-7-5-13(6-8-14)19(22)25-4/h5-12H,1-4H3,(H,20,21)