2-[3-[5-(phenylcarbonyl)pyridin-2-yl]prop-2-ynylamino]benzenecarboximidamide

Systemtic Name: 2-[3-[5-(phenylcarbonyl)pyridin-2-yl]prop-2-ynylamino]benzenecarboximidamide Openeye Name: 2-[3-(5-benzoyl-2-pyridyl)prop-2-ynylamino]benzamidine CAS Name: 2-[3-(5-benzoyl-2-pyridinyl)prop-2-ynylamino]benzenecarboximidamide IUPAC Name: 2-[3-(5-benzoylpyridin-2-yl)prop-2-ynylamino]benzenecarboximidamide Traditional Name: 2-[3-(5-benzoyl-2-pyridyl)prop-2-ynylamino]benzamidine Formula: C22H18N4O MolecularWeight: 354.40452

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)C2=CN=C(C=C2)C#CCNC3=CC=CC=C3C(=N)N

Isomeric SMILES

C1=CC=C(C=C1)C(=O)C2=CN=C(C=C2)C#CCNC3=CC=CC=C3C(=N)N

InChI

InChI=1S/C22H18N4O/c23-22(24)19-10-4-5-11-20(19)25-14-6-9-18-13-12-17(15-26-18)21(27)16-7-2-1-3-8-16/h1-5,7-8,10-13,15,25H,14H2,(H3,23,24)