N'-[C-(2,6-dimethylphenyl)-N-(4-fluorophenyl)carbonimidoyl]-2-methyl-N-piperidin-1-yl-piperidine-1-carboximidamide

Systemtic Name: N'-[C-(2,6-dimethylphenyl)-N-(4-fluorophenyl)carbonimidoyl]-2-methyl-N-piperidin-1-yl-piperidine-1-carboximidamide Openeye Name: N'-[C-(2,6-dimethylphenyl)-N-(4-fluorophenyl)carbonimidoyl]-2-methyl-N-(1-piperidyl)piperidine-1-carboxamidine CAS Name: N'-[(2,6-dimethylphenyl)-(4-fluorophenyl)iminomethyl]-2-methyl-N-(1-piperidinyl)-1-piperidinecarboximidamide IUPAC Name: N'-[C-(2,6-dimethylphenyl)-N-(4-fluorophenyl)carbonimidoyl]-2-methyl-N-piperidin-1-ylpiperidine-1-carboximidamide Traditional Name: N'-[C-(2,6-dimethylphenyl)-N-(4-fluorophenyl)carbonimidoyl]-2-methyl-N-piperidino-piperidine-1-carboxamidine Formula: C27H36FN5 MolecularWeight: 449.606643

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1C(=NC(=NC2=CC=C(C=C2)F)C3=C(C=CC=C3C)C)NN4CCCCC4

Isomeric SMILES

CC1CCCCN1C(=NC(=NC2=CC=C(C=C2)F)C3=C(C=CC=C3C)C)NN4CCCCC4

InChI

InChI=1S/C27H36FN5/c1-20-10-9-11-21(2)25(20)26(29-24-15-13-23(28)14-16-24)30-27(31-32-17-6-4-7-18-32)33-19-8-5-12-22(33)3/h9-11,13-16,22H,4-8,12,17-19H2,1-3H3,(H,29,30,31)