5-(3-fluoranyl-4-methoxy-phenyl)-N-[(1-piperidin-1-ylcyclopentyl)methyl]-1,2,4-triazin-3-amine

Systemtic Name: 5-(3-fluoranyl-4-methoxy-phenyl)-N-[(1-piperidin-1-ylcyclopentyl)methyl]-1,2,4-triazin-3-amine Openeye Name: 5-(3-fluoro-4-methoxy-phenyl)-N-[[1-(1-piperidyl)cyclopentyl]methyl]-1,2,4-triazin-3-amine CAS Name: 5-(3-fluoro-4-methoxyphenyl)-N-[[1-(1-piperidinyl)cyclopentyl]methyl]-1,2,4-triazin-3-amine IUPAC Name: 5-(3-fluoro-4-methoxyphenyl)-N-[(1-piperidin-1-ylcyclopentyl)methyl]-1,2,4-triazin-3-amine Traditional Name: [5-(3-fluoro-4-methoxy-phenyl)-1,2,4-triazin-3-yl]-[(1-piperidinocyclopentyl)methyl]amine Formula: C21H28FN5O MolecularWeight: 385.478323

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=CN=NC(=N2)NCC3(CCCC3)N4CCCCC4)F

Isomeric SMILES

COC1=C(C=C(C=C1)C2=CN=NC(=N2)NCC3(CCCC3)N4CCCCC4)F

InChI

InChI=1S/C21H28FN5O/c1-28-19-8-7-16(13-17(19)22)18-14-24-26-20(25-18)23-15-21(9-3-4-10-21)27-11-5-2-6-12-27/h7-8,13-14H,2-6,9-12,15H2,1H3,(H,23,25,26)