3-azanyl-N-(2-azanylcyclohexyl)-4-[[methyl(2-pyridin-2-ylethyl)amino]methyl]benzamide

Systemtic Name: 3-azanyl-N-(2-azanylcyclohexyl)-4-[[methyl(2-pyridin-2-ylethyl)amino]methyl]benzamide Openeye Name: 3-amino-N-(2-aminocyclohexyl)-4-[[methyl-[2-(2-pyridyl)ethyl]amino]methyl]benzamide CAS Name: 3-amino-N-(2-aminocyclohexyl)-4-[[methyl-[2-(2-pyridinyl)ethyl]amino]methyl]benzamide IUPAC Name: 3-amino-N-(2-aminocyclohexyl)-4-[[methyl(2-pyridin-2-ylethyl)amino]methyl]benzamide Traditional Name: 3-amino-N-(2-aminocyclohexyl)-4-[[methyl-[2-(2-pyridyl)ethyl]amino]methyl]benzamide Formula: C22H31N5O MolecularWeight: 381.51444

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CCC1=CC=CC=N1)CC2=C(C=C(C=C2)C(=O)NC3CCCCC3N)N

Isomeric SMILES

CN(CCC1=CC=CC=N1)CC2=C(C=C(C=C2)C(=O)NC3CCCCC3N)N

InChI

InChI=1S/C22H31N5O/c1-27(13-11-18-6-4-5-12-25-18)15-17-10-9-16(14-20(17)24)22(28)26-21-8-3-2-7-19(21)23/h4-6,9-10,12,14,19,21H,2-3,7-8,11,13,15,23-24H2,1H3,(H,26,28)