methyl 2-[2-(4-aminophenyl)sulfanylbutanoylamino]benzoate

Systemtic Name: methyl 2-[2-(4-aminophenyl)sulfanylbutanoylamino]benzoate Openeye Name: methyl 2-[2-(4-aminophenyl)sulfanylbutanoylamino]benzoate CAS Name: 2-[[2-[(4-aminophenyl)thio]-1-oxobutyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[2-(4-aminophenyl)sulfanylbutanoylamino]benzoate Traditional Name: 2-[2-[(4-aminophenyl)thio]butanoylamino]benzoic acid methyl ester Formula: C18H20N2O3S MolecularWeight: 344.428

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=CC=C1C(=O)OC)SC2=CC=C(C=C2)N

Isomeric SMILES

CCC(C(=O)NC1=CC=CC=C1C(=O)OC)SC2=CC=C(C=C2)N

InChI

InChI=1S/C18H20N2O3S/c1-3-16(24-13-10-8-12(19)9-11-13)17(21)20-15-7-5-4-6-14(15)18(22)23-2/h4-11,16H,3,19H2,1-2H3,(H,20,21)