5-(3-fluoranyl-4-methoxy-phenyl)-3-[3-(pyridin-3-ylmethoxy)piperidin-1-yl]-1,2,4-triazine

Systemtic Name: 5-(3-fluoranyl-4-methoxy-phenyl)-3-[3-(pyridin-3-ylmethoxy)piperidin-1-yl]-1,2,4-triazine Openeye Name: 5-(3-fluoro-4-methoxy-phenyl)-3-[3-(3-pyridylmethoxy)-1-piperidyl]-1,2,4-triazine CAS Name: 5-(3-fluoro-4-methoxyphenyl)-3-[3-(3-pyridinylmethoxy)-1-piperidinyl]-1,2,4-triazine IUPAC Name: 5-(3-fluoro-4-methoxyphenyl)-3-[3-(pyridin-3-ylmethoxy)piperidin-1-yl]-1,2,4-triazine Traditional Name: 5-(3-fluoro-4-methoxy-phenyl)-3-[3-(3-pyridylmethoxy)piperidino]-1,2,4-triazine Formula: C21H22FN5O2 MolecularWeight: 395.430083

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=CN=NC(=N2)N3CCCC(C3)OCC4=CN=CC=C4)F

Isomeric SMILES

COC1=C(C=C(C=C1)C2=CN=NC(=N2)N3CCCC(C3)OCC4=CN=CC=C4)F

InChI

InChI=1S/C21H22FN5O2/c1-28-20-7-6-16(10-18(20)22)19-12-24-26-21(25-19)27-9-3-5-17(13-27)29-14-15-4-2-8-23-11-15/h2,4,6-8,10-12,17H,3,5,9,13-14H2,1H3