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

Systemtic Name: N6-(4-azanyl-3-fluoranyl-phenyl)-N4-cycloheptyl-N2-methyl-N2-(1-methylpiperidin-4-yl)-1,3,5-triazine-2,4,6-triamine Openeye Name: N6-(4-amino-3-fluoro-phenyl)-N4-cycloheptyl-N2-methyl-N2-(1-methyl-4-piperidyl)-1,3,5-triazine-2,4,6-triamine CAS Name: N6-(4-amino-3-fluorophenyl)-N4-cycloheptyl-N2-methyl-N2-(1-methyl-4-piperidinyl)-1,3,5-triazine-2,4,6-triamine IUPAC Name: 6-N-(4-amino-3-fluorophenyl)-4-N-cycloheptyl-2-N-methyl-2-N-(1-methylpiperidin-4-yl)-1,3,5-triazine-2,4,6-triamine Traditional Name: [4-(4-amino-3-fluoro-anilino)-6-(cycloheptylamino)-s-triazin-2-yl]-methyl-(1-methyl-4-piperidyl)amine Formula: C23H35FN8 MolecularWeight: 442.576003

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC(CC1)N(C)C2=NC(=NC(=N2)NC3CCCCCC3)NC4=CC(=C(C=C4)N)F

Isomeric SMILES

CN1CCC(CC1)N(C)C2=NC(=NC(=N2)NC3CCCCCC3)NC4=CC(=C(C=C4)N)F

InChI

InChI=1S/C23H35FN8/c1-31-13-11-18(12-14-31)32(2)23-29-21(26-16-7-5-3-4-6-8-16)28-22(30-23)27-17-9-10-20(25)19(24)15-17/h9-10,15-16,18H,3-8,11-14,25H2,1-2H3,(H2,26,27,28,29,30)