2-[(3-methylphenyl)-(phenylsulfonyl)amino]-N-[3-(phenylmethylsulfanyl)propyl]ethanamide

Systemtic Name: 2-[(3-methylphenyl)-(phenylsulfonyl)amino]-N-[3-(phenylmethylsulfanyl)propyl]ethanamide Openeye Name: 2-[N-(benzenesulfonyl)-3-methyl-anilino]-N-(3-benzylsulfanylpropyl)acetamide CAS Name: 2-[N-(benzenesulfonyl)-3-methylanilino]-N-[3-(phenylmethylthio)propyl]acetamide IUPAC Name: 2-[N-(benzenesulfonyl)-3-methylanilino]-N-(3-benzylsulfanylpropyl)acetamide Traditional Name: N-[3-(benzylthio)propyl]-2-(N-besyl-3-methyl-anilino)acetamide Formula: C25H28N2O3S2 MolecularWeight: 468.63142

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N(CC(=O)NCCCSCC2=CC=CC=C2)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CC1=CC(=CC=C1)N(CC(=O)NCCCSCC2=CC=CC=C2)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C25H28N2O3S2/c1-21-10-8-13-23(18-21)27(32(29,30)24-14-6-3-7-15-24)19-25(28)26-16-9-17-31-20-22-11-4-2-5-12-22/h2-8,10-15,18H,9,16-17,19-20H2,1H3,(H,26,28)