N-[(2-fluorophenyl)methyl]-2-methyl-N-(2-morpholin-4-ylethyl)-5-nitro-1,2,4-triazol-3-amine

Systemtic Name: N-[(2-fluorophenyl)methyl]-2-methyl-N-(2-morpholin-4-ylethyl)-5-nitro-1,2,4-triazol-3-amine Openeye Name: N-[(2-fluorophenyl)methyl]-2-methyl-N-(2-morpholinoethyl)-5-nitro-1,2,4-triazol-3-amine CAS Name: N-[(2-fluorophenyl)methyl]-2-methyl-N-[2-(4-morpholinyl)ethyl]-5-nitro-1,2,4-triazol-3-amine IUPAC Name: N-[(2-fluorophenyl)methyl]-2-methyl-N-(2-morpholin-4-ylethyl)-5-nitro-1,2,4-triazol-3-amine Traditional Name: (2-fluorobenzyl)-(2-methyl-5-nitro-1,2,4-triazol-3-yl)-(2-morpholinoethyl)amine Formula: C16H21FN6O3 MolecularWeight: 364.374743

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NC(=N1)[N+](=O)[O-])N(CCN2CCOCC2)CC3=CC=CC=C3F

Isomeric SMILES

CN1C(=NC(=N1)[N+](=O)[O-])N(CCN2CCOCC2)CC3=CC=CC=C3F

InChI

InChI=1S/C16H21FN6O3/c1-20-16(18-15(19-20)23(24)25)22(7-6-21-8-10-26-11-9-21)12-13-4-2-3-5-14(13)17/h2-5H,6-12H2,1H3