N-[3-[(4-methylphenyl)methylsulfanyl]propyl]-2-[(4-methylphenyl)sulfonyl-phenyl-amino]ethanamide

Systemtic Name: N-[3-[(4-methylphenyl)methylsulfanyl]propyl]-2-[(4-methylphenyl)sulfonyl-phenyl-amino]ethanamide Openeye Name: N-[3-(p-tolylmethylsulfanyl)propyl]-2-[N-(p-tolylsulfonyl)anilino]acetamide CAS Name: N-[3-[(4-methylphenyl)methylthio]propyl]-2-(N-(4-methylphenyl)sulfonylanilino)acetamide IUPAC Name: N-[3-[(4-methylphenyl)methylsulfanyl]propyl]-2-(N-(4-methylphenyl)sulfonylanilino)acetamide Traditional Name: N-[3-[(4-methylbenzyl)thio]propyl]-2-(N-tosylanilino)acetamide Formula: C26H30N2O3S2 MolecularWeight: 482.658

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CSCCCNC(=O)CN(C2=CC=CC=C2)S(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CC1=CC=C(C=C1)CSCCCNC(=O)CN(C2=CC=CC=C2)S(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C26H30N2O3S2/c1-21-9-13-23(14-10-21)20-32-18-6-17-27-26(29)19-28(24-7-4-3-5-8-24)33(30,31)25-15-11-22(2)12-16-25/h3-5,7-16H,6,17-20H2,1-2H3,(H,27,29)