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

Systemtic Name: N6-cycloheptyl-N4-cyclopentyl-N2-(3-fluoranyl-4-methoxy-phenyl)-1,3,5-triazine-2,4,6-triamine Openeye Name: N6-cycloheptyl-N4-cyclopentyl-N2-(3-fluoro-4-methoxy-phenyl)-1,3,5-triazine-2,4,6-triamine CAS Name: N6-cycloheptyl-N4-cyclopentyl-N2-(3-fluoro-4-methoxyphenyl)-1,3,5-triazine-2,4,6-triamine IUPAC Name: 6-N-cycloheptyl-4-N-cyclopentyl-2-N-(3-fluoro-4-methoxyphenyl)-1,3,5-triazine-2,4,6-triamine Traditional Name: cycloheptyl-[4-(cyclopentylamino)-6-(3-fluoro-4-methoxy-anilino)-s-triazin-2-yl]amine Formula: C22H31FN6O MolecularWeight: 414.519543

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC2=NC(=NC(=N2)NC3CCCC3)NC4CCCCCC4)F

Isomeric SMILES

COC1=C(C=C(C=C1)NC2=NC(=NC(=N2)NC3CCCC3)NC4CCCCCC4)F

InChI

InChI=1S/C22H31FN6O/c1-30-19-13-12-17(14-18(19)23)26-22-28-20(24-15-8-4-2-3-5-9-15)27-21(29-22)25-16-10-6-7-11-16/h12-16H,2-11H2,1H3,(H3,24,25,26,27,28,29)