N-[3-morpholin-4-ylcarbonyl-4-[4-(phenylmethyl)piperazin-1-yl]phenyl]cyclobutanecarboxamide

Systemtic Name: N-[3-morpholin-4-ylcarbonyl-4-[4-(phenylmethyl)piperazin-1-yl]phenyl]cyclobutanecarboxamide Openeye Name: N-[4-(4-benzylpiperazin-1-yl)-3-(morpholine-4-carbonyl)phenyl]cyclobutanecarboxamide CAS Name: N-[3-[4-morpholinyl(oxo)methyl]-4-[4-(phenylmethyl)-1-piperazinyl]phenyl]cyclobutanecarboxamide IUPAC Name: N-[4-(4-benzylpiperazin-1-yl)-3-(morpholine-4-carbonyl)phenyl]cyclobutanecarboxamide Traditional Name: N-[4-(4-benzylpiperazino)-3-(morpholine-4-carbonyl)phenyl]cyclobutanecarboxamide Formula: C27H34N4O3 MolecularWeight: 462.58386

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(C1)C(=O)NC2=CC(=C(C=C2)N3CCN(CC3)CC4=CC=CC=C4)C(=O)N5CCOCC5

Isomeric SMILES

C1CC(C1)C(=O)NC2=CC(=C(C=C2)N3CCN(CC3)CC4=CC=CC=C4)C(=O)N5CCOCC5

InChI

InChI=1S/C27H34N4O3/c32-26(22-7-4-8-22)28-23-9-10-25(24(19-23)27(33)31-15-17-34-18-16-31)30-13-11-29(12-14-30)20-21-5-2-1-3-6-21/h1-3,5-6,9-10,19,22H,4,7-8,11-18,20H2,(H,28,32)