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

Systemtic Name: butyl 4-[2-(4-aminophenyl)sulfanylbutanoylamino]benzoate Openeye Name: butyl 4-[2-(4-aminophenyl)sulfanylbutanoylamino]benzoate CAS Name: 4-[[2-[(4-aminophenyl)thio]-1-oxobutyl]amino]benzoic acid butyl ester IUPAC Name: butyl 4-[2-(4-aminophenyl)sulfanylbutanoylamino]benzoate Traditional Name: 4-[2-[(4-aminophenyl)thio]butanoylamino]benzoic acid butyl ester Formula: C21H26N2O3S MolecularWeight: 386.50774

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)C(CC)SC2=CC=C(C=C2)N

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)C(CC)SC2=CC=C(C=C2)N

InChI

InChI=1S/C21H26N2O3S/c1-3-5-14-26-21(25)15-6-10-17(11-7-15)23-20(24)19(4-2)27-18-12-8-16(22)9-13-18/h6-13,19H,3-5,14,22H2,1-2H3,(H,23,24)