4-[[4-(phenylmethyl)piperazin-1-yl]methyl]-N-[1-(pyridin-3-ylmethyl)piperidin-4-yl]benzamide

Systemtic Name: 4-[[4-(phenylmethyl)piperazin-1-yl]methyl]-N-[1-(pyridin-3-ylmethyl)piperidin-4-yl]benzamide Openeye Name: 4-[(4-benzylpiperazin-1-yl)methyl]-N-[1-(3-pyridylmethyl)-4-piperidyl]benzamide CAS Name: 4-[[4-(phenylmethyl)-1-piperazinyl]methyl]-N-[1-(3-pyridinylmethyl)-4-piperidinyl]benzamide IUPAC Name: 4-[(4-benzylpiperazin-1-yl)methyl]-N-[1-(pyridin-3-ylmethyl)piperidin-4-yl]benzamide Traditional Name: 4-[(4-benzylpiperazino)methyl]-N-[1-(3-pyridylmethyl)-4-piperidyl]benzamide Formula: C30H37N5O MolecularWeight: 483.64768

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1NC(=O)C2=CC=C(C=C2)CN3CCN(CC3)CC4=CC=CC=C4)CC5=CN=CC=C5

Isomeric SMILES

C1CN(CCC1NC(=O)C2=CC=C(C=C2)CN3CCN(CC3)CC4=CC=CC=C4)CC5=CN=CC=C5

InChI

InChI=1S/C30H37N5O/c36-30(32-29-12-15-33(16-13-29)24-27-7-4-14-31-21-27)28-10-8-26(9-11-28)23-35-19-17-34(18-20-35)22-25-5-2-1-3-6-25/h1-11,14,21,29H,12-13,15-20,22-24H2,(H,32,36)