N-[[4-[[(2-chlorophenyl)methylcarbamoylamino]methyl]cyclohexyl]methyl]pyridine-4-carboxamide

Systemtic Name: N-[[4-[[(2-chlorophenyl)methylcarbamoylamino]methyl]cyclohexyl]methyl]pyridine-4-carboxamide Openeye Name: N-[[4-[[(2-chlorophenyl)methylcarbamoylamino]methyl]cyclohexyl]methyl]pyridine-4-carboxamide CAS Name: N-[[4-[[[[(2-chlorophenyl)methylamino]-oxomethyl]amino]methyl]cyclohexyl]methyl]-4-pyridinecarboxamide IUPAC Name: N-[[4-[[(2-chlorophenyl)methylcarbamoylamino]methyl]cyclohexyl]methyl]pyridine-4-carboxamide Traditional Name: N-[[4-[[(2-chlorobenzyl)carbamoylamino]methyl]cyclohexyl]methyl]isonicotinamide Formula: C22H27ClN4O2 MolecularWeight: 414.92838

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1CNC(=O)C2=CC=NC=C2)CNC(=O)NCC3=CC=CC=C3Cl

Isomeric SMILES

C1CC(CCC1CNC(=O)C2=CC=NC=C2)CNC(=O)NCC3=CC=CC=C3Cl

InChI

InChI=1S/C22H27ClN4O2/c23-20-4-2-1-3-19(20)15-27-22(29)26-14-17-7-5-16(6-8-17)13-25-21(28)18-9-11-24-12-10-18/h1-4,9-12,16-17H,5-8,13-15H2,(H,25,28)(H2,26,27,29)