1-[3-[3-(diethylaminomethyl)phenoxy]propyl]-1,2,4-triazole-3,5-diamine

Systemtic Name: 1-[3-[3-(diethylaminomethyl)phenoxy]propyl]-1,2,4-triazole-3,5-diamine Openeye Name: 1-[3-[3-(diethylaminomethyl)phenoxy]propyl]-1,2,4-triazole-3,5-diamine CAS Name: 1-[3-[3-(diethylaminomethyl)phenoxy]propyl]-1,2,4-triazole-3,5-diamine IUPAC Name: 1-[3-[3-(diethylaminomethyl)phenoxy]propyl]-1,2,4-triazole-3,5-diamine Traditional Name: [3-[3-(3,5-diamino-1,2,4-triazol-1-yl)propoxy]benzyl]-diethyl-amine Formula: C16H26N6O MolecularWeight: 318.41724

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC1=CC(=CC=C1)OCCCN2C(=NC(=N2)N)N

Isomeric SMILES

CCN(CC)CC1=CC(=CC=C1)OCCCN2C(=NC(=N2)N)N

InChI

InChI=1S/C16H26N6O/c1-3-21(4-2)12-13-7-5-8-14(11-13)23-10-6-9-22-16(18)19-15(17)20-22/h5,7-8,11H,3-4,6,9-10,12H2,1-2H3,(H4,17,18,19,20)