3-[[N-(3-carbamimidoylphenyl)-C-phenyl-carbonimidoyl]amino]benzenecarboximidamide

Systemtic Name: 3-[[N-(3-carbamimidoylphenyl)-C-phenyl-carbonimidoyl]amino]benzenecarboximidamide Openeye Name: 3-[[N-(3-carbamimidoylphenyl)-C-phenyl-carbonimidoyl]amino]benzamidine CAS Name: 3-[[(3-carbamimidoylphenyl)imino-phenylmethyl]amino]benzenecarboximidamide IUPAC Name: 3-[[N-(3-carbamimidoylphenyl)-C-phenylcarbonimidoyl]amino]benzenecarboximidamide Traditional Name: 3-[[N-(3-amidinophenyl)-C-phenyl-carbonimidoyl]amino]benzamidine Formula: C21H20N6 MolecularWeight: 356.4237

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=NC2=CC=CC(=C2)C(=N)N)NC3=CC=CC(=C3)C(=N)N

Isomeric SMILES

C1=CC=C(C=C1)C(=NC2=CC=CC(=C2)C(=N)N)NC3=CC=CC(=C3)C(=N)N

InChI

InChI=1S/C21H20N6/c22-19(23)15-8-4-10-17(12-15)26-21(14-6-2-1-3-7-14)27-18-11-5-9-16(13-18)20(24)25/h1-13H,(H3,22,23)(H3,24,25)(H,26,27)