N4-cycloheptyl-N6-(3-fluoranyl-4-methoxy-phenyl)-N2-methyl-N2-piperidin-4-yl-1,3,5-triazine-2,4,6-triamine

Systemtic Name: N4-cycloheptyl-N6-(3-fluoranyl-4-methoxy-phenyl)-N2-methyl-N2-piperidin-4-yl-1,3,5-triazine-2,4,6-triamine Openeye Name: N4-cycloheptyl-N6-(3-fluoro-4-methoxy-phenyl)-N2-methyl-N2-(4-piperidyl)-1,3,5-triazine-2,4,6-triamine CAS Name: N4-cycloheptyl-N6-(3-fluoro-4-methoxyphenyl)-N2-methyl-N2-(4-piperidinyl)-1,3,5-triazine-2,4,6-triamine IUPAC Name: 4-N-cycloheptyl-6-N-(3-fluoro-4-methoxyphenyl)-2-N-methyl-2-N-piperidin-4-yl-1,3,5-triazine-2,4,6-triamine Traditional Name: [4-(cycloheptylamino)-6-(3-fluoro-4-methoxy-anilino)-s-triazin-2-yl]-methyl-(4-piperidyl)amine Formula: C23H34FN7O MolecularWeight: 443.560763

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCNCC1)C2=NC(=NC(=N2)NC3CCCCCC3)NC4=CC(=C(C=C4)OC)F

Isomeric SMILES

CN(C1CCNCC1)C2=NC(=NC(=N2)NC3CCCCCC3)NC4=CC(=C(C=C4)OC)F

InChI

InChI=1S/C23H34FN7O/c1-31(18-11-13-25-14-12-18)23-29-21(26-16-7-5-3-4-6-8-16)28-22(30-23)27-17-9-10-20(32-2)19(24)15-17/h9-10,15-16,18,25H,3-8,11-14H2,1-2H3,(H2,26,27,28,29,30)