1-[[2-[[4-(phenylmethyl)piperazin-1-yl]methyl]-1,3-oxazol-4-yl]carbonyl]piperidine-3-carboxamide

Systemtic Name: 1-[[2-[[4-(phenylmethyl)piperazin-1-yl]methyl]-1,3-oxazol-4-yl]carbonyl]piperidine-3-carboxamide Openeye Name: 1-[2-[(4-benzylpiperazin-1-yl)methyl]oxazole-4-carbonyl]piperidine-3-carboxamide CAS Name: 1-[oxo-[2-[[4-(phenylmethyl)-1-piperazinyl]methyl]-4-oxazolyl]methyl]-3-piperidinecarboxamide IUPAC Name: 1-[2-[(4-benzylpiperazin-1-yl)methyl]-1,3-oxazole-4-carbonyl]piperidine-3-carboxamide Traditional Name: 1-[2-[(4-benzylpiperazino)methyl]oxazole-4-carbonyl]nipecotamide Formula: C22H29N5O3 MolecularWeight: 411.49736

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)C2=COC(=N2)CN3CCN(CC3)CC4=CC=CC=C4)C(=O)N

Isomeric SMILES

C1CC(CN(C1)C(=O)C2=COC(=N2)CN3CCN(CC3)CC4=CC=CC=C4)C(=O)N

InChI

InChI=1S/C22H29N5O3/c23-21(28)18-7-4-8-27(14-18)22(29)19-16-30-20(24-19)15-26-11-9-25(10-12-26)13-17-5-2-1-3-6-17/h1-3,5-6,16,18H,4,7-15H2,(H2,23,28)