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

Systemtic Name: N-[[4-[[(2-chlorophenyl)methylcarbamoylamino]methyl]cyclohexyl]methyl]-2-methyl-pentanamide Openeye Name: N-[[4-[[(2-chlorophenyl)methylcarbamoylamino]methyl]cyclohexyl]methyl]-2-methyl-pentanamide CAS Name: N-[[4-[[[[(2-chlorophenyl)methylamino]-oxomethyl]amino]methyl]cyclohexyl]methyl]-2-methylpentanamide IUPAC Name: N-[[4-[[(2-chlorophenyl)methylcarbamoylamino]methyl]cyclohexyl]methyl]-2-methylpentanamide Traditional Name: N-[[4-[[(2-chlorobenzyl)carbamoylamino]methyl]cyclohexyl]methyl]-2-methyl-valeramide Formula: C22H34ClN3O2 MolecularWeight: 407.97726

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)C(=O)NCC1CCC(CC1)CNC(=O)NCC2=CC=CC=C2Cl

Isomeric SMILES

CCCC(C)C(=O)NCC1CCC(CC1)CNC(=O)NCC2=CC=CC=C2Cl

InChI

InChI=1S/C22H34ClN3O2/c1-3-6-16(2)21(27)24-13-17-9-11-18(12-10-17)14-25-22(28)26-15-19-7-4-5-8-20(19)23/h4-5,7-8,16-18H,3,6,9-15H2,1-2H3,(H,24,27)(H2,25,26,28)