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

Systemtic Name: 1-[3-[3-(propylaminomethyl)phenoxy]propyl]-1,2,4-triazole-3,5-diamine Openeye Name: 1-[3-[3-(propylaminomethyl)phenoxy]propyl]-1,2,4-triazole-3,5-diamine CAS Name: 1-[3-[3-(propylaminomethyl)phenoxy]propyl]-1,2,4-triazole-3,5-diamine IUPAC Name: 1-[3-[3-(propylaminomethyl)phenoxy]propyl]-1,2,4-triazole-3,5-diamine Traditional Name: [3-[3-(3,5-diamino-1,2,4-triazol-1-yl)propoxy]benzyl]-propyl-amine Formula: C15H24N6O MolecularWeight: 304.39066

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Descriptors Computed from Structure

Canonical SMILES:

CCCNCC1=CC(=CC=C1)OCCCN2C(=NC(=N2)N)N

Isomeric SMILES

CCCNCC1=CC(=CC=C1)OCCCN2C(=NC(=N2)N)N

InChI

InChI=1S/C15H24N6O/c1-2-7-18-11-12-5-3-6-13(10-12)22-9-4-8-21-15(17)19-14(16)20-21/h3,5-6,10,18H,2,4,7-9,11H2,1H3,(H4,16,17,19,20)