ethyl 6-[(4-methylphenyl)sulfonylamino]-2-[(2-phenyl-3H-benzimidazol-5-yl)sulfonylamino]hexanoate

Systemtic Name: ethyl 6-[(4-methylphenyl)sulfonylamino]-2-[(2-phenyl-3H-benzimidazol-5-yl)sulfonylamino]hexanoate Openeye Name: ethyl 2-[(2-phenyl-3H-benzimidazol-5-yl)sulfonylamino]-6-(p-tolylsulfonylamino)hexanoate CAS Name: 6-[(4-methylphenyl)sulfonylamino]-2-[(2-phenyl-3H-benzimidazol-5-yl)sulfonylamino]hexanoic acid ethyl ester IUPAC Name: ethyl 6-[(4-methylphenyl)sulfonylamino]-2-[(2-phenyl-3H-benzimidazol-5-yl)sulfonylamino]hexanoate Traditional Name: 2-[(2-phenyl-3H-benzimidazol-5-yl)sulfonylamino]-6-(tosylamino)hexanoic acid ethyl ester Formula: C28H32N4O6S2 MolecularWeight: 584.70688

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CCCCNS(=O)(=O)C1=CC=C(C=C1)C)NS(=O)(=O)C2=CC3=C(C=C2)N=C(N3)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C(CCCCNS(=O)(=O)C1=CC=C(C=C1)C)NS(=O)(=O)C2=CC3=C(C=C2)N=C(N3)C4=CC=CC=C4

InChI

InChI=1S/C28H32N4O6S2/c1-3-38-28(33)25(11-7-8-18-29-39(34,35)22-14-12-20(2)13-15-22)32-40(36,37)23-16-17-24-26(19-23)31-27(30-24)21-9-5-4-6-10-21/h4-6,9-10,12-17,19,25,29,32H,3,7-8,11,18H2,1-2H3,(H,30,31)