2-[(2-methylphenyl)-(4-methylphenyl)sulfonyl-amino]-N-(3-phenylsulfanylpropyl)ethanamide

Systemtic Name: 2-[(2-methylphenyl)-(4-methylphenyl)sulfonyl-amino]-N-(3-phenylsulfanylpropyl)ethanamide Openeye Name: 2-[2-methyl-N-(p-tolylsulfonyl)anilino]-N-(3-phenylsulfanylpropyl)acetamide CAS Name: 2-(2-methyl-N-(4-methylphenyl)sulfonylanilino)-N-[3-(phenylthio)propyl]acetamide IUPAC Name: 2-(2-methyl-N-(4-methylphenyl)sulfonylanilino)-N-(3-phenylsulfanylpropyl)acetamide Traditional Name: 2-(2-methyl-N-tosyl-anilino)-N-[3-(phenylthio)propyl]acetamide Formula: C25H28N2O3S2 MolecularWeight: 468.63142

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(CC(=O)NCCCSC2=CC=CC=C2)C3=CC=CC=C3C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(CC(=O)NCCCSC2=CC=CC=C2)C3=CC=CC=C3C

InChI

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