N2-cycloheptyl-N4-(3-fluoranyl-4-methoxy-phenyl)-6-piperidin-4-yloxy-1,3,5-triazine-2,4-diamine

Systemtic Name: N2-cycloheptyl-N4-(3-fluoranyl-4-methoxy-phenyl)-6-piperidin-4-yloxy-1,3,5-triazine-2,4-diamine Openeye Name: N2-cycloheptyl-N4-(3-fluoro-4-methoxy-phenyl)-6-(4-piperidyloxy)-1,3,5-triazine-2,4-diamine CAS Name: N2-cycloheptyl-N4-(3-fluoro-4-methoxyphenyl)-6-(4-piperidinyloxy)-1,3,5-triazine-2,4-diamine IUPAC Name: 2-N-cycloheptyl-4-N-(3-fluoro-4-methoxyphenyl)-6-piperidin-4-yloxy-1,3,5-triazine-2,4-diamine Traditional Name: cycloheptyl-[4-(3-fluoro-4-methoxy-anilino)-6-(4-piperidyloxy)-s-triazin-2-yl]amine Formula: C22H31FN6O2 MolecularWeight: 430.518943

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC2=NC(=NC(=N2)OC3CCNCC3)NC4CCCCCC4)F

Isomeric SMILES

COC1=C(C=C(C=C1)NC2=NC(=NC(=N2)OC3CCNCC3)NC4CCCCCC4)F

InChI

InChI=1S/C22H31FN6O2/c1-30-19-9-8-16(14-18(19)23)26-21-27-20(25-15-6-4-2-3-5-7-15)28-22(29-21)31-17-10-12-24-13-11-17/h8-9,14-15,17,24H,2-7,10-13H2,1H3,(H2,25,26,27,28,29)