methyl 4-chloranyl-3-[2-(4-chlorophenyl)sulfanylbutanoylamino]benzoate

Systemtic Name: methyl 4-chloranyl-3-[2-(4-chlorophenyl)sulfanylbutanoylamino]benzoate Openeye Name: methyl 4-chloro-3-[2-(4-chlorophenyl)sulfanylbutanoylamino]benzoate CAS Name: 4-chloro-3-[[2-[(4-chlorophenyl)thio]-1-oxobutyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-chloro-3-[2-(4-chlorophenyl)sulfanylbutanoylamino]benzoate Traditional Name: 4-chloro-3-[2-[(4-chlorophenyl)thio]butanoylamino]benzoic acid methyl ester Formula: C18H17Cl2NO3S MolecularWeight: 398.30348

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H17Cl2NO3S/c1-3-16(25-13-7-5-12(19)6-8-13)17(22)21-15-10-11(18(23)24-2)4-9-14(15)20/h4-10,16H,3H2,1-2H3,(H,21,22)