N'-[(1-carbamimidoylpiperidin-4-yl)methyl]-2-(cyclohexylmethyl)-2-phenyl-butanediamide

Systemtic Name: N'-[(1-carbamimidoylpiperidin-4-yl)methyl]-2-(cyclohexylmethyl)-2-phenyl-butanediamide Openeye Name: N'-[(1-carbamimidoyl-4-piperidyl)methyl]-2-(cyclohexylmethyl)-2-phenyl-butanediamide CAS Name: N'-[(1-carbamimidoyl-4-piperidinyl)methyl]-2-(cyclohexylmethyl)-2-phenylbutanediamide IUPAC Name: N'-[(1-carbamimidoylpiperidin-4-yl)methyl]-2-(cyclohexylmethyl)-2-phenylbutanediamide Traditional Name: N'-[(1-amidino-4-piperidyl)methyl]-2-(cyclohexylmethyl)-2-phenyl-succinamide Formula: C24H37N5O2 MolecularWeight: 427.58288

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CC(CC(=O)NCC2CCN(CC2)C(=N)N)(C3=CC=CC=C3)C(=O)N

Isomeric SMILES

C1CCC(CC1)CC(CC(=O)NCC2CCN(CC2)C(=N)N)(C3=CC=CC=C3)C(=O)N

InChI

InChI=1S/C24H37N5O2/c25-22(31)24(20-9-5-2-6-10-20,15-18-7-3-1-4-8-18)16-21(30)28-17-19-11-13-29(14-12-19)23(26)27/h2,5-6,9-10,18-19H,1,3-4,7-8,11-17H2,(H2,25,31)(H3,26,27)(H,28,30)