N'-[C-(2,6-dimethylphenyl)-N-(4-fluorophenyl)carbonimidoyl]-2-methyl-N-pyridin-3-yl-piperidine-1-carboximidamide

Systemtic Name: N'-[C-(2,6-dimethylphenyl)-N-(4-fluorophenyl)carbonimidoyl]-2-methyl-N-pyridin-3-yl-piperidine-1-carboximidamide Openeye Name: N'-[C-(2,6-dimethylphenyl)-N-(4-fluorophenyl)carbonimidoyl]-2-methyl-N-(3-pyridyl)piperidine-1-carboxamidine CAS Name: N'-[(2,6-dimethylphenyl)-(4-fluorophenyl)iminomethyl]-2-methyl-N-(3-pyridinyl)-1-piperidinecarboximidamide IUPAC Name: N'-[C-(2,6-dimethylphenyl)-N-(4-fluorophenyl)carbonimidoyl]-2-methyl-N-pyridin-3-ylpiperidine-1-carboximidamide Traditional Name: N'-[C-(2,6-dimethylphenyl)-N-(4-fluorophenyl)carbonimidoyl]-2-methyl-N-(3-pyridyl)piperidine-1-carboxamidine Formula: C27H30FN5 MolecularWeight: 443.559003

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1C(=NC(=NC2=CC=C(C=C2)F)C3=C(C=CC=C3C)C)NC4=CN=CC=C4

Isomeric SMILES

CC1CCCCN1C(=NC(=NC2=CC=C(C=C2)F)C3=C(C=CC=C3C)C)NC4=CN=CC=C4

InChI

InChI=1S/C27H30FN5/c1-19-8-6-9-20(2)25(19)26(30-23-14-12-22(28)13-15-23)32-27(31-24-11-7-16-29-18-24)33-17-5-4-10-21(33)3/h6-9,11-16,18,21H,4-5,10,17H2,1-3H3,(H,30,31,32)