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

Systemtic Name: N2-cycloheptyl-N6-[(3-fluoranyl-4-methoxy-phenyl)methyl]-N2-methyl-N4-piperidin-4-yl-1,3,5-triazine-2,4,6-triamine Openeye Name: N2-cycloheptyl-N6-[(3-fluoro-4-methoxy-phenyl)methyl]-N2-methyl-N4-(4-piperidyl)-1,3,5-triazine-2,4,6-triamine CAS Name: N2-cycloheptyl-N6-[(3-fluoro-4-methoxyphenyl)methyl]-N2-methyl-N4-(4-piperidinyl)-1,3,5-triazine-2,4,6-triamine IUPAC Name: 2-N-cycloheptyl-6-N-[(3-fluoro-4-methoxyphenyl)methyl]-2-N-methyl-4-N-piperidin-4-yl-1,3,5-triazine-2,4,6-triamine Traditional Name: cycloheptyl-[4-[(3-fluoro-4-methoxy-benzyl)amino]-6-(4-piperidylamino)-s-triazin-2-yl]-methyl-amine Formula: C24H36FN7O MolecularWeight: 457.587343

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCCCCC1)C2=NC(=NC(=N2)NCC3=CC(=C(C=C3)OC)F)NC4CCNCC4

Isomeric SMILES

CN(C1CCCCCC1)C2=NC(=NC(=N2)NCC3=CC(=C(C=C3)OC)F)NC4CCNCC4

InChI

InChI=1S/C24H36FN7O/c1-32(19-7-5-3-4-6-8-19)24-30-22(27-16-17-9-10-21(33-2)20(25)15-17)29-23(31-24)28-18-11-13-26-14-12-18/h9-10,15,18-19,26H,3-8,11-14,16H2,1-2H3,(H2,27,28,29,30,31)