1-[N-(4,6-dimethylpyrimidin-2-yl)-N'-(phenylcarbonyl)carbamimidoyl]piperidine-4-carboxamide

Systemtic Name: 1-[N-(4,6-dimethylpyrimidin-2-yl)-N'-(phenylcarbonyl)carbamimidoyl]piperidine-4-carboxamide Openeye Name: 1-[N'-benzoyl-N-(4,6-dimethylpyrimidin-2-yl)carbamimidoyl]piperidine-4-carboxamide CAS Name: 1-[benzoylimino-[(4,6-dimethyl-2-pyrimidinyl)amino]methyl]-4-piperidinecarboxamide IUPAC Name: 1-[N'-benzoyl-N-(4,6-dimethylpyrimidin-2-yl)carbamimidoyl]piperidine-4-carboxamide Traditional Name: 1-[N'-benzoyl-N-(4,6-dimethylpyrimidin-2-yl)amidino]isonipecotamide Formula: C20H24N6O2 MolecularWeight: 380.44356

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)NC(=NC(=O)C2=CC=CC=C2)N3CCC(CC3)C(=O)N)C

Isomeric SMILES

CC1=CC(=NC(=N1)NC(=NC(=O)C2=CC=CC=C2)N3CCC(CC3)C(=O)N)C

InChI

InChI=1S/C20H24N6O2/c1-13-12-14(2)23-19(22-13)25-20(24-18(28)16-6-4-3-5-7-16)26-10-8-15(9-11-26)17(21)27/h3-7,12,15H,8-11H2,1-2H3,(H2,21,27)(H,22,23,24,25,28)