4-[[(4-acetamidophenyl)sulfonylamino]methyl]-N-(pyridin-3-ylmethyl)cyclohexane-1-carboxamide

Systemtic Name: 4-[[(4-acetamidophenyl)sulfonylamino]methyl]-N-(pyridin-3-ylmethyl)cyclohexane-1-carboxamide Openeye Name: 4-[[(4-acetamidophenyl)sulfonylamino]methyl]-N-(3-pyridylmethyl)cyclohexanecarboxamide CAS Name: 4-[[(4-acetamidophenyl)sulfonylamino]methyl]-N-(3-pyridinylmethyl)-1-cyclohexanecarboxamide IUPAC Name: 4-[[(4-acetamidophenyl)sulfonylamino]methyl]-N-(pyridin-3-ylmethyl)cyclohexane-1-carboxamide Traditional Name: 4-[[(4-acetamidophenyl)sulfonylamino]methyl]-N-(3-pyridylmethyl)cyclohexanecarboxamide Formula: C22H28N4O4S MolecularWeight: 444.54712

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)NCC2CCC(CC2)C(=O)NCC3=CN=CC=C3

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)NCC2CCC(CC2)C(=O)NCC3=CN=CC=C3

InChI

InChI=1S/C22H28N4O4S/c1-16(27)26-20-8-10-21(11-9-20)31(29,30)25-15-17-4-6-19(7-5-17)22(28)24-14-18-3-2-12-23-13-18/h2-3,8-13,17,19,25H,4-7,14-15H2,1H3,(H,24,28)(H,26,27)