N-[2-(butylamino)-2-oxidanylidene-ethyl]-4-[[(4-fluorophenyl)sulfonylamino]methyl]cyclohexane-1-carboxamide

Systemtic Name: N-[2-(butylamino)-2-oxidanylidene-ethyl]-4-[[(4-fluorophenyl)sulfonylamino]methyl]cyclohexane-1-carboxamide Openeye Name: N-[2-(butylamino)-2-oxo-ethyl]-4-[[(4-fluorophenyl)sulfonylamino]methyl]cyclohexanecarboxamide CAS Name: N-[2-(butylamino)-2-oxoethyl]-4-[[(4-fluorophenyl)sulfonylamino]methyl]-1-cyclohexanecarboxamide IUPAC Name: N-[2-(butylamino)-2-oxoethyl]-4-[[(4-fluorophenyl)sulfonylamino]methyl]cyclohexane-1-carboxamide Traditional Name: N-[2-(butylamino)-2-keto-ethyl]-4-[[(4-fluorophenyl)sulfonylamino]methyl]cyclohexanecarboxamide Formula: C20H30FN3O4S MolecularWeight: 427.533303

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)CNC(=O)C1CCC(CC1)CNS(=O)(=O)C2=CC=C(C=C2)F

Isomeric SMILES

CCCCNC(=O)CNC(=O)C1CCC(CC1)CNS(=O)(=O)C2=CC=C(C=C2)F

InChI

InChI=1S/C20H30FN3O4S/c1-2-3-12-22-19(25)14-23-20(26)16-6-4-15(5-7-16)13-24-29(27,28)18-10-8-17(21)9-11-18/h8-11,15-16,24H,2-7,12-14H2,1H3,(H,22,25)(H,23,26)