1-ethyl-N-[2-(4-fluorophenyl)-2-morpholin-4-yl-ethyl]benzotriazole-5-carboxamide

Systemtic Name: 1-ethyl-N-[2-(4-fluorophenyl)-2-morpholin-4-yl-ethyl]benzotriazole-5-carboxamide Openeye Name: 1-ethyl-N-[2-(4-fluorophenyl)-2-morpholino-ethyl]benzotriazole-5-carboxamide CAS Name: 1-ethyl-N-[2-(4-fluorophenyl)-2-(4-morpholinyl)ethyl]-5-benzotriazolecarboxamide IUPAC Name: 1-ethyl-N-[2-(4-fluorophenyl)-2-morpholin-4-ylethyl]benzotriazole-5-carboxamide Traditional Name: 1-ethyl-N-[2-(4-fluorophenyl)-2-morpholino-ethyl]benzotriazole-5-carboxamide Formula: C21H24FN5O2 MolecularWeight: 397.445963

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)C(=O)NCC(C3=CC=C(C=C3)F)N4CCOCC4)N=N1

Isomeric SMILES

CCN1C2=C(C=C(C=C2)C(=O)NCC(C3=CC=C(C=C3)F)N4CCOCC4)N=N1

InChI

InChI=1S/C21H24FN5O2/c1-2-27-19-8-5-16(13-18(19)24-25-27)21(28)23-14-20(26-9-11-29-12-10-26)15-3-6-17(22)7-4-15/h3-8,13,20H,2,9-12,14H2,1H3,(H,23,28)