2-[(3,5-dimethylphenyl)-(phenylsulfonyl)amino]-N-(3-phenylsulfanylpropyl)ethanamide

Systemtic Name: 2-[(3,5-dimethylphenyl)-(phenylsulfonyl)amino]-N-(3-phenylsulfanylpropyl)ethanamide Openeye Name: 2-[N-(benzenesulfonyl)-3,5-dimethyl-anilino]-N-(3-phenylsulfanylpropyl)acetamide CAS Name: 2-[N-(benzenesulfonyl)-3,5-dimethylanilino]-N-[3-(phenylthio)propyl]acetamide IUPAC Name: 2-[N-(benzenesulfonyl)-3,5-dimethylanilino]-N-(3-phenylsulfanylpropyl)acetamide Traditional Name: 2-(N-besyl-3,5-dimethyl-anilino)-N-[3-(phenylthio)propyl]acetamide Formula: C25H28N2O3S2 MolecularWeight: 468.63142

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)N(CC(=O)NCCCSC2=CC=CC=C2)S(=O)(=O)C3=CC=CC=C3)C

Isomeric SMILES

CC1=CC(=CC(=C1)N(CC(=O)NCCCSC2=CC=CC=C2)S(=O)(=O)C3=CC=CC=C3)C

InChI

InChI=1S/C25H28N2O3S2/c1-20-16-21(2)18-22(17-20)27(32(29,30)24-12-7-4-8-13-24)19-25(28)26-14-9-15-31-23-10-5-3-6-11-23/h3-8,10-13,16-18H,9,14-15,19H2,1-2H3,(H,26,28)