2-azanyl-N'-[(E)-2-chloranyl-3-[5-(phenylcarbonyl)pyridin-2-yl]prop-2-enyl]benzenecarboximidamide

Systemtic Name: 2-azanyl-N'-[(E)-2-chloranyl-3-[5-(phenylcarbonyl)pyridin-2-yl]prop-2-enyl]benzenecarboximidamide Openeye Name: 2-amino-N'-[(E)-3-(5-benzoyl-2-pyridyl)-2-chloro-allyl]benzamidine CAS Name: 2-amino-N'-[(E)-3-(5-benzoyl-2-pyridinyl)-2-chloroprop-2-enyl]benzenecarboximidamide IUPAC Name: 2-amino-N'-[(E)-3-(5-benzoylpyridin-2-yl)-2-chloroprop-2-enyl]benzenecarboximidamide Traditional Name: 2-amino-N'-[(E)-3-(5-benzoyl-2-pyridyl)-2-chloro-allyl]benzamidine Formula: C22H19ClN4O MolecularWeight: 390.86546

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)C2=CN=C(C=C2)C=C(CN=C(C3=CC=CC=C3N)N)Cl

Isomeric SMILES

C1=CC=C(C=C1)C(=O)C2=CN=C(C=C2)/C=C(\CN=C(C3=CC=CC=C3N)N)/Cl

InChI

InChI=1S/C22H19ClN4O/c23-17(14-27-22(25)19-8-4-5-9-20(19)24)12-18-11-10-16(13-26-18)21(28)15-6-2-1-3-7-15/h1-13H,14,24H2,(H2,25,27)/b17-12+