N-[2-[3-[(4-methylphenyl)sulfonyl-phenyl-amino]propanoylamino]ethyl]benzamide

Systemtic Name: N-[2-[3-[(4-methylphenyl)sulfonyl-phenyl-amino]propanoylamino]ethyl]benzamide Openeye Name: N-[2-[3-[N-(p-tolylsulfonyl)anilino]propanoylamino]ethyl]benzamide CAS Name: N-[2-[[3-(N-(4-methylphenyl)sulfonylanilino)-1-oxopropyl]amino]ethyl]benzamide IUPAC Name: N-[2-[3-(N-(4-methylphenyl)sulfonylanilino)propanoylamino]ethyl]benzamide Traditional Name: N-[2-[3-(N-tosylanilino)propanoylamino]ethyl]benzamide Formula: C25H27N3O4S MolecularWeight: 465.56458

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(CCC(=O)NCCNC(=O)C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(CCC(=O)NCCNC(=O)C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C25H27N3O4S/c1-20-12-14-23(15-13-20)33(31,32)28(22-10-6-3-7-11-22)19-16-24(29)26-17-18-27-25(30)21-8-4-2-5-9-21/h2-15H,16-19H2,1H3,(H,26,29)(H,27,30)