4-[(E)-[5-oxidanylidene-2-(1-phenylcyclopentyl)-1,3-oxazol-4-ylidene]methyl]-N'-pyridin-2-yl-piperazine-1-carboximidamide

Systemtic Name: 4-[(E)-[5-oxidanylidene-2-(1-phenylcyclopentyl)-1,3-oxazol-4-ylidene]methyl]-N'-pyridin-2-yl-piperazine-1-carboximidamide Openeye Name: 4-[(E)-[5-oxo-2-(1-phenylcyclopentyl)oxazol-4-ylidene]methyl]-N'-(2-pyridyl)piperazine-1-carboxamidine CAS Name: 4-[(E)-[5-oxo-2-(1-phenylcyclopentyl)-4-oxazolylidene]methyl]-N'-(2-pyridinyl)-1-piperazinecarboximidamide IUPAC Name: 4-[(E)-[5-oxo-2-(1-phenylcyclopentyl)-1,3-oxazol-4-ylidene]methyl]-N'-pyridin-2-ylpiperazine-1-carboximidamide Traditional Name: 4-[(E)-[5-keto-2-(1-phenylcyclopentyl)-2-oxazolin-4-ylidene]methyl]-N'-(2-pyridyl)piperazine-1-carboxamidine Formula: C25H28N6O2 MolecularWeight: 444.52882

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)(C2=CC=CC=C2)C3=NC(=CN4CCN(CC4)C(=NC5=CC=CC=N5)N)C(=O)O3

Isomeric SMILES

C1CCC(C1)(C2=CC=CC=C2)C3=N/C(=C/N4CCN(CC4)/C(=N\C5=CC=CC=N5)/N)/C(=O)O3

InChI

InChI=1S/C25H28N6O2/c26-24(29-21-10-4-7-13-27-21)31-16-14-30(15-17-31)18-20-22(32)33-23(28-20)25(11-5-6-12-25)19-8-2-1-3-9-19/h1-4,7-10,13,18H,5-6,11-12,14-17H2,(H2,26,27,29)/b20-18+