2-morpholin-4-yl-N-[4-[4-(phenylmethyl)piperazin-1-yl]phenyl]pyridine-3-carboxamide

Systemtic Name: 2-morpholin-4-yl-N-[4-[4-(phenylmethyl)piperazin-1-yl]phenyl]pyridine-3-carboxamide Openeye Name: N-[4-(4-benzylpiperazin-1-yl)phenyl]-2-morpholino-pyridine-3-carboxamide CAS Name: 2-(4-morpholinyl)-N-[4-[4-(phenylmethyl)-1-piperazinyl]phenyl]-3-pyridinecarboxamide IUPAC Name: N-[4-(4-benzylpiperazin-1-yl)phenyl]-2-morpholin-4-ylpyridine-3-carboxamide Traditional Name: N-[4-(4-benzylpiperazino)phenyl]-2-morpholino-nicotinamide Formula: C27H31N5O2 MolecularWeight: 457.56734

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2)C3=CC=C(C=C3)NC(=O)C4=C(N=CC=C4)N5CCOCC5

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2)C3=CC=C(C=C3)NC(=O)C4=C(N=CC=C4)N5CCOCC5

InChI

InChI=1S/C27H31N5O2/c33-27(25-7-4-12-28-26(25)32-17-19-34-20-18-32)29-23-8-10-24(11-9-23)31-15-13-30(14-16-31)21-22-5-2-1-3-6-22/h1-12H,13-21H2,(H,29,33)