4-methyl-N-[3-[(4-methylphenyl)sulfonyl-[3-[3-[(4-methylphenyl)sulfonyl-[3-[(4-methylphenyl)sulfonylamino]propyl]amino]propyl-(phenylmethyl)amino]propyl]amino]propyl]benzenesulfonamide

Systemtic Name: 4-methyl-N-[3-[(4-methylphenyl)sulfonyl-[3-[3-[(4-methylphenyl)sulfonyl-[3-[(4-methylphenyl)sulfonylamino]propyl]amino]propyl-(phenylmethyl)amino]propyl]amino]propyl]benzenesulfonamide Openeye Name: N-[3-[3-[benzyl-[3-[p-tolylsulfonyl-[3-(p-tolylsulfonylamino)propyl]amino]propyl]amino]propyl-(p-tolylsulfonyl)amino]propyl]-4-methyl-benzenesulfonamide CAS Name: 4-methyl-N-[3-[(4-methylphenyl)sulfonyl-[3-[3-[(4-methylphenyl)sulfonyl-[3-[(4-methylphenyl)sulfonylamino]propyl]amino]propyl-(phenylmethyl)amino]propyl]amino]propyl]benzenesulfonamide IUPAC Name: N-[3-[3-[benzyl-[3-[(4-methylphenyl)sulfonyl-[3-[(4-methylphenyl)sulfonylamino]propyl]amino]propyl]amino]propyl-(4-methylphenyl)sulfonylamino]propyl]-4-methylbenzenesulfonamide Traditional Name: N-[3-[3-[benzyl-[3-[tosyl-[3-(tosylamino)propyl]amino]propyl]amino]propyl-tosyl-amino]propyl]-4-methyl-benzenesulfonamide Formula: C47H61N5O8S4 MolecularWeight: 952.27594

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NCCCN(CCCN(CCCN(CCCNS(=O)(=O)C2=CC=C(C=C2)C)S(=O)(=O)C3=CC=C(C=C3)C)CC4=CC=CC=C4)S(=O)(=O)C5=CC=C(C=C5)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NCCCN(CCCN(CCCN(CCCNS(=O)(=O)C2=CC=C(C=C2)C)S(=O)(=O)C3=CC=C(C=C3)C)CC4=CC=CC=C4)S(=O)(=O)C5=CC=C(C=C5)C

InChI

InChI=1S/C47H61N5O8S4/c1-39-14-22-44(23-15-39)61(53,54)48-30-8-34-51(63(57,58)46-26-18-41(3)19-27-46)36-10-32-50(38-43-12-6-5-7-13-43)33-11-37-52(64(59,60)47-28-20-42(4)21-29-47)35-9-31-49-62(55,56)45-24-16-40(2)17-25-45/h5-7,12-29,48-49H,8-11,30-38H2,1-4H3