[3,5-bis(chloranyl)phenyl] 4-(2-methylsulfanylpropanoylamino)benzoate

Systemtic Name: [3,5-bis(chloranyl)phenyl] 4-(2-methylsulfanylpropanoylamino)benzoate Openeye Name: (3,5-dichlorophenyl) 4-(2-methylsulfanylpropanoylamino)benzoate CAS Name: 4-[[2-(methylthio)-1-oxopropyl]amino]benzoic acid (3,5-dichlorophenyl) ester IUPAC Name: (3,5-dichlorophenyl) 4-(2-methylsulfanylpropanoylamino)benzoate Traditional Name: 4-[2-(methylthio)propanoylamino]benzoic acid (3,5-dichlorophenyl) ester Formula: C17H15Cl2NO3S MolecularWeight: 384.2769

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)C(=O)OC2=CC(=CC(=C2)Cl)Cl)SC

Isomeric SMILES

CC(C(=O)NC1=CC=C(C=C1)C(=O)OC2=CC(=CC(=C2)Cl)Cl)SC

InChI

InChI=1S/C17H15Cl2NO3S/c1-10(24-2)16(21)20-14-5-3-11(4-6-14)17(22)23-15-8-12(18)7-13(19)9-15/h3-10H,1-2H3,(H,20,21)