butyl 4-[2-[4-(phenylsulfonylamino)phenyl]sulfanylpropanoylamino]benzoate

Systemtic Name: butyl 4-[2-[4-(phenylsulfonylamino)phenyl]sulfanylpropanoylamino]benzoate Openeye Name: butyl 4-[2-[4-(benzenesulfonamido)phenyl]sulfanylpropanoylamino]benzoate CAS Name: 4-[[2-[[4-(benzenesulfonamido)phenyl]thio]-1-oxopropyl]amino]benzoic acid butyl ester IUPAC Name: butyl 4-[2-[4-(benzenesulfonamido)phenyl]sulfanylpropanoylamino]benzoate Traditional Name: 4-[2-[[4-(benzenesulfonamido)phenyl]thio]propanoylamino]benzoic acid butyl ester Formula: C26H28N2O5S2 MolecularWeight: 512.64092

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)C(C)SC2=CC=C(C=C2)NS(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)C(C)SC2=CC=C(C=C2)NS(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C26H28N2O5S2/c1-3-4-18-33-26(30)20-10-12-21(13-11-20)27-25(29)19(2)34-23-16-14-22(15-17-23)28-35(31,32)24-8-6-5-7-9-24/h5-17,19,28H,3-4,18H2,1-2H3,(H,27,29)