methyl 4-[2-[(5-ethanoyl-2-methoxy-phenyl)methylsulfanyl]ethanoylamino]benzoate

Systemtic Name: methyl 4-[2-[(5-ethanoyl-2-methoxy-phenyl)methylsulfanyl]ethanoylamino]benzoate Openeye Name: methyl 4-[[2-[(5-acetyl-2-methoxy-phenyl)methylsulfanyl]acetyl]amino]benzoate CAS Name: 4-[[2-[(5-acetyl-2-methoxyphenyl)methylthio]-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[2-[(5-acetyl-2-methoxyphenyl)methylsulfanyl]acetyl]amino]benzoate Traditional Name: 4-[[2-[(5-acetyl-2-methoxy-benzyl)thio]acetyl]amino]benzoic acid methyl ester Formula: C20H21NO5S MolecularWeight: 387.44944

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C=C1)OC)CSCC(=O)NC2=CC=C(C=C2)C(=O)OC

Isomeric SMILES

CC(=O)C1=CC(=C(C=C1)OC)CSCC(=O)NC2=CC=C(C=C2)C(=O)OC

InChI

InChI=1S/C20H21NO5S/c1-13(22)15-6-9-18(25-2)16(10-15)11-27-12-19(23)21-17-7-4-14(5-8-17)20(24)26-3/h4-10H,11-12H2,1-3H3,(H,21,23)