methanol; 1-methyl-N5-(3-phenoxypropyl)-1,2,4-triazole-3,5-diamine

Systemtic Name: methanol; 1-methyl-N5-(3-phenoxypropyl)-1,2,4-triazole-3,5-diamine Openeye Name: methanol; 1-methyl-N5-(3-phenoxypropyl)-1,2,4-triazole-3,5-diamine CAS Name: methanol; 1-methyl-N5-(3-phenoxypropyl)-1,2,4-triazole-3,5-diamine IUPAC Name: methanol; 1-methyl-5-N-(3-phenoxypropyl)-1,2,4-triazole-3,5-diamine Traditional Name: (5-amino-2-methyl-1,2,4-triazol-3-yl)-(3-phenoxypropyl)amine; methanol Formula: C13H21N5O2 MolecularWeight: 279.33814

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NC(=N1)N)NCCCOC2=CC=CC=C2.CO

Isomeric SMILES

CN1C(=NC(=N1)N)NCCCOC2=CC=CC=C2.CO

InChI

InChI=1S/C12H17N5O.CH4O/c1-17-12(15-11(13)16-17)14-8-5-9-18-10-6-3-2-4-7-10;1-2/h2-4,6-7H,5,8-9H2,1H3,(H3,13,14,15,16);2H,1H3