3-[4-(diphenylmethyl)piperazin-1-yl]-N-[(E)-1-pyridin-4-ylethylideneamino]propanamide

Systemtic Name: 3-[4-(diphenylmethyl)piperazin-1-yl]-N-[(E)-1-pyridin-4-ylethylideneamino]propanamide Openeye Name: 3-(4-benzhydrylpiperazin-1-yl)-N-[(E)-1-(4-pyridyl)ethylideneamino]propanamide CAS Name: 3-[4-(diphenylmethyl)-1-piperazinyl]-N-[(E)-1-pyridin-4-ylethylideneamino]propanamide IUPAC Name: 3-(4-benzhydrylpiperazin-1-yl)-N-[(E)-1-pyridin-4-ylethylideneamino]propanamide Traditional Name: 3-(4-benzhydrylpiperazino)-N-[(E)-1-(4-pyridyl)ethylideneamino]propionamide Formula: C27H31N5O MolecularWeight: 441.56794

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)CCN1CCN(CC1)C(C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=NC=C4

Isomeric SMILES

C/C(=N\NC(=O)CCN1CCN(CC1)C(C2=CC=CC=C2)C3=CC=CC=C3)/C4=CC=NC=C4

InChI

InChI=1S/C27H31N5O/c1-22(23-12-15-28-16-13-23)29-30-26(33)14-17-31-18-20-32(21-19-31)27(24-8-4-2-5-9-24)25-10-6-3-7-11-25/h2-13,15-16,27H,14,17-21H2,1H3,(H,30,33)/b29-22+