N-butyl-2-[3-[(4-methylphenyl)sulfonylamino]propanoylamino]benzamide

Systemtic Name: N-butyl-2-[3-[(4-methylphenyl)sulfonylamino]propanoylamino]benzamide Openeye Name: N-butyl-2-[3-(p-tolylsulfonylamino)propanoylamino]benzamide CAS Name: N-butyl-2-[[3-[(4-methylphenyl)sulfonylamino]-1-oxopropyl]amino]benzamide IUPAC Name: N-butyl-2-[3-[(4-methylphenyl)sulfonylamino]propanoylamino]benzamide Traditional Name: N-butyl-2-[3-(tosylamino)propanoylamino]benzamide Formula: C21H27N3O4S MolecularWeight: 417.52178

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C1=CC=CC=C1NC(=O)CCNS(=O)(=O)C2=CC=C(C=C2)C

Isomeric SMILES

CCCCNC(=O)C1=CC=CC=C1NC(=O)CCNS(=O)(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C21H27N3O4S/c1-3-4-14-22-21(26)18-7-5-6-8-19(18)24-20(25)13-15-23-29(27,28)17-11-9-16(2)10-12-17/h5-12,23H,3-4,13-15H2,1-2H3,(H,22,26)(H,24,25)