N-(2-azanylcyclohexyl)-3-(cyclohexylcarbonylamino)-4-[[4-(phenylmethyl)piperidin-1-yl]methyl]benzamide

Systemtic Name: N-(2-azanylcyclohexyl)-3-(cyclohexylcarbonylamino)-4-[[4-(phenylmethyl)piperidin-1-yl]methyl]benzamide Openeye Name: N-(2-aminocyclohexyl)-4-[(4-benzyl-1-piperidyl)methyl]-3-(cyclohexanecarbonylamino)benzamide CAS Name: N-(2-aminocyclohexyl)-3-[[cyclohexyl(oxo)methyl]amino]-4-[[4-(phenylmethyl)-1-piperidinyl]methyl]benzamide IUPAC Name: N-(2-aminocyclohexyl)-4-[(4-benzylpiperidin-1-yl)methyl]-3-(cyclohexanecarbonylamino)benzamide Traditional Name: N-(2-aminocyclohexyl)-4-[(4-benzylpiperidino)methyl]-3-(cyclohexanecarbonylamino)benzamide Formula: C33H46N4O2 MolecularWeight: 530.74394

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(=O)NC2=C(C=CC(=C2)C(=O)NC3CCCCC3N)CN4CCC(CC4)CC5=CC=CC=C5

Isomeric SMILES

C1CCC(CC1)C(=O)NC2=C(C=CC(=C2)C(=O)NC3CCCCC3N)CN4CCC(CC4)CC5=CC=CC=C5

InChI

InChI=1S/C33H46N4O2/c34-29-13-7-8-14-30(29)35-33(39)27-15-16-28(31(22-27)36-32(38)26-11-5-2-6-12-26)23-37-19-17-25(18-20-37)21-24-9-3-1-4-10-24/h1,3-4,9-10,15-16,22,25-26,29-30H,2,5-8,11-14,17-21,23,34H2,(H,35,39)(H,36,38)