N-cyclopentyl-2-methyl-5-nitro-N-(pyridin-4-ylmethyl)-1,2,4-triazol-3-amine

Systemtic Name: N-cyclopentyl-2-methyl-5-nitro-N-(pyridin-4-ylmethyl)-1,2,4-triazol-3-amine Openeye Name: N-cyclopentyl-2-methyl-5-nitro-N-(4-pyridylmethyl)-1,2,4-triazol-3-amine CAS Name: N-cyclopentyl-2-methyl-5-nitro-N-(pyridin-4-ylmethyl)-1,2,4-triazol-3-amine IUPAC Name: N-cyclopentyl-2-methyl-5-nitro-N-(pyridin-4-ylmethyl)-1,2,4-triazol-3-amine Traditional Name: cyclopentyl-(2-methyl-5-nitro-1,2,4-triazol-3-yl)-(4-pyridylmethyl)amine Formula: C14H18N6O2 MolecularWeight: 302.33172

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NC(=N1)[N+](=O)[O-])N(CC2=CC=NC=C2)C3CCCC3

Isomeric SMILES

CN1C(=NC(=N1)[N+](=O)[O-])N(CC2=CC=NC=C2)C3CCCC3

InChI

InChI=1S/C14H18N6O2/c1-18-14(16-13(17-18)20(21)22)19(12-4-2-3-5-12)10-11-6-8-15-9-7-11/h6-9,12H,2-5,10H2,1H3