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

Systemtic Name: 4-[(E)-[2-(3-methylphenyl)-5-oxidanylidene-1,3-oxazol-4-ylidene]methyl]-N'-pyridin-2-yl-piperazine-1-carboximidamide Openeye Name: 4-[(E)-[2-(m-tolyl)-5-oxo-oxazol-4-ylidene]methyl]-N'-(2-pyridyl)piperazine-1-carboxamidine CAS Name: 4-[(E)-[2-(3-methylphenyl)-5-oxo-4-oxazolylidene]methyl]-N'-(2-pyridinyl)-1-piperazinecarboximidamide IUPAC Name: 4-[(E)-[2-(3-methylphenyl)-5-oxo-1,3-oxazol-4-ylidene]methyl]-N'-pyridin-2-ylpiperazine-1-carboximidamide Traditional Name: 4-[(E)-[5-keto-2-(m-tolyl)-2-oxazolin-4-ylidene]methyl]-N'-(2-pyridyl)piperazine-1-carboxamidine Formula: C21H22N6O2 MolecularWeight: 390.43838

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=NC(=CN3CCN(CC3)C(=NC4=CC=CC=N4)N)C(=O)O2

Isomeric SMILES

CC1=CC=CC(=C1)C2=N/C(=C/N3CCN(CC3)/C(=N\C4=CC=CC=N4)/N)/C(=O)O2

InChI

InChI=1S/C21H22N6O2/c1-15-5-4-6-16(13-15)19-24-17(20(28)29-19)14-26-9-11-27(12-10-26)21(22)25-18-7-2-3-8-23-18/h2-8,13-14H,9-12H2,1H3,(H2,22,23,25)/b17-14+