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

Systemtic Name: N'-[[3-(3-methylphenyl)-3-oxidanylidene-1-pyridin-3-yl-propyl]amino]pyridine-2-carboximidamide Openeye Name: N'-[[3-(m-tolyl)-3-oxo-1-(3-pyridyl)propyl]amino]pyridine-2-carboxamidine CAS Name: N'-[[3-(3-methylphenyl)-3-oxo-1-(3-pyridinyl)propyl]amino]-2-pyridinecarboximidamide IUPAC Name: N'-[[3-(3-methylphenyl)-3-oxo-1-pyridin-3-ylpropyl]amino]pyridine-2-carboximidamide Traditional Name: N'-[[3-keto-3-(m-tolyl)-1-(3-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=CN=CC=C2)NN=C(C3=CC=CC=N3)N

Isomeric SMILES

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

InChI

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