ethyl 4-[5-(3-fluoranyl-4-methoxy-phenyl)-1,2,4-triazin-3-yl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[5-(3-fluoranyl-4-methoxy-phenyl)-1,2,4-triazin-3-yl]piperazine-1-carboxylate Openeye Name: ethyl 4-[5-(3-fluoro-4-methoxy-phenyl)-1,2,4-triazin-3-yl]piperazine-1-carboxylate CAS Name: 4-[5-(3-fluoro-4-methoxyphenyl)-1,2,4-triazin-3-yl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[5-(3-fluoro-4-methoxyphenyl)-1,2,4-triazin-3-yl]piperazine-1-carboxylate Traditional Name: 4-[5-(3-fluoro-4-methoxy-phenyl)-1,2,4-triazin-3-yl]piperazine-1-carboxylic acid ethyl ester Formula: C17H20FN5O3 MolecularWeight: 361.370803

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C2=NC(=CN=N2)C3=CC(=C(C=C3)OC)F

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C2=NC(=CN=N2)C3=CC(=C(C=C3)OC)F

InChI

InChI=1S/C17H20FN5O3/c1-3-26-17(24)23-8-6-22(7-9-23)16-20-14(11-19-21-16)12-4-5-15(25-2)13(18)10-12/h4-5,10-11H,3,6-9H2,1-2H3