methyl 2-[[2-(butylsulfonylamino)pentyl-phenyl-carbamoyl]-ethyl-amino]cyclohexane-1-carboxylate

Systemtic Name: methyl 2-[[2-(butylsulfonylamino)pentyl-phenyl-carbamoyl]-ethyl-amino]cyclohexane-1-carboxylate Openeye Name: methyl 2-[[2-(butylsulfonylamino)pentyl-phenyl-carbamoyl]-ethyl-amino]cyclohexanecarboxylate CAS Name: 2-[[[N-[2-(butylsulfonylamino)pentyl]anilino]-oxomethyl]-ethylamino]-1-cyclohexanecarboxylic acid methyl ester IUPAC Name: methyl 2-[[2-(butylsulfonylamino)pentyl-phenylcarbamoyl]-ethylamino]cyclohexane-1-carboxylate Traditional Name: 2-[[2-(butylsulfonylamino)pentyl-phenyl-carbamoyl]-ethyl-amino]cyclohexanecarboxylic acid methyl ester Formula: C26H43N3O5S MolecularWeight: 509.70172

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Descriptors Computed from Structure

Canonical SMILES:

CCCCS(=O)(=O)NC(CCC)CN(C1=CC=CC=C1)C(=O)N(CC)C2CCCCC2C(=O)OC

Isomeric SMILES

CCCCS(=O)(=O)NC(CCC)CN(C1=CC=CC=C1)C(=O)N(CC)C2CCCCC2C(=O)OC

InChI

InChI=1S/C26H43N3O5S/c1-5-8-19-35(32,33)27-21(14-6-2)20-29(22-15-10-9-11-16-22)26(31)28(7-3)24-18-13-12-17-23(24)25(30)34-4/h9-11,15-16,21,23-24,27H,5-8,12-14,17-20H2,1-4H3