4-acetamido-N-[N-(3,5-dimethylphenyl)-N'-(pyridin-4-ylmethyl)carbamimidoyl]benzamide

Systemtic Name: 4-acetamido-N-[N-(3,5-dimethylphenyl)-N'-(pyridin-4-ylmethyl)carbamimidoyl]benzamide Openeye Name: 4-acetamido-N-[N-(3,5-dimethylphenyl)-N'-(4-pyridylmethyl)carbamimidoyl]benzamide CAS Name: 4-acetamido-N-[(3,5-dimethylanilino)-(pyridin-4-ylmethylimino)methyl]benzamide IUPAC Name: 4-acetamido-N-[N-(3,5-dimethylphenyl)-N'-(pyridin-4-ylmethyl)carbamimidoyl]benzamide Traditional Name: 4-acetamido-N-[N-(3,5-dimethylphenyl)-N'-(4-pyridylmethyl)amidino]benzamide Formula: C24H25N5O2 MolecularWeight: 415.4876

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NC(=NCC2=CC=NC=C2)NC(=O)C3=CC=C(C=C3)NC(=O)C)C

Isomeric SMILES

CC1=CC(=CC(=C1)NC(=NCC2=CC=NC=C2)NC(=O)C3=CC=C(C=C3)NC(=O)C)C

InChI

InChI=1S/C24H25N5O2/c1-16-12-17(2)14-22(13-16)28-24(26-15-19-8-10-25-11-9-19)29-23(31)20-4-6-21(7-5-20)27-18(3)30/h4-14H,15H2,1-3H3,(H,27,30)(H2,26,28,29,31)