N'-[[3-(3-methylphenyl)-3-oxidanylidene-1-pyridin-4-yl-propyl]amino]pyridine-2-carboximidamide

Systemtic Name: N'-[[3-(3-methylphenyl)-3-oxidanylidene-1-pyridin-4-yl-propyl]amino]pyridine-2-carboximidamide Openeye Name: N'-[[3-(m-tolyl)-3-oxo-1-(4-pyridyl)propyl]amino]pyridine-2-carboxamidine CAS Name: N'-[[3-(3-methylphenyl)-3-oxo-1-pyridin-4-ylpropyl]amino]-2-pyridinecarboximidamide IUPAC Name: N'-[[3-(3-methylphenyl)-3-oxo-1-pyridin-4-ylpropyl]amino]pyridine-2-carboximidamide Traditional Name: N'-[[3-keto-3-(m-tolyl)-1-(4-pyridyl)propyl]amino]picolinamidine Formula: C21H21N5O MolecularWeight: 359.42434

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)CC(C2=CC=NC=C2)NN=C(C3=CC=CC=N3)N

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)CC(C2=CC=NC=C2)N/N=C(/C3=CC=CC=N3)\N

InChI

InChI=1S/C21H21N5O/c1-15-5-4-6-17(13-15)20(27)14-19(16-8-11-23-12-9-16)25-26-21(22)18-7-2-3-10-24-18/h2-13,19,25H,14H2,1H3,(H2,22,26)