butyl 4-[2-(3-acetamidophenyl)sulfanylbutanoylamino]benzoate

Systemtic Name: butyl 4-[2-(3-acetamidophenyl)sulfanylbutanoylamino]benzoate Openeye Name: butyl 4-[2-(3-acetamidophenyl)sulfanylbutanoylamino]benzoate CAS Name: 4-[[2-[(3-acetamidophenyl)thio]-1-oxobutyl]amino]benzoic acid butyl ester IUPAC Name: butyl 4-[2-(3-acetamidophenyl)sulfanylbutanoylamino]benzoate Traditional Name: 4-[2-[(3-acetamidophenyl)thio]butanoylamino]benzoic acid butyl ester Formula: C23H28N2O4S MolecularWeight: 428.54442

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H28N2O4S/c1-4-6-14-29-23(28)17-10-12-18(13-11-17)25-22(27)21(5-2)30-20-9-7-8-19(15-20)24-16(3)26/h7-13,15,21H,4-6,14H2,1-3H3,(H,24,26)(H,25,27)