1-[4-[3-(piperidin-1-ylmethyl)phenoxy]butyl]-1,2,4-triazole-3,5-diamine

Systemtic Name: 1-[4-[3-(piperidin-1-ylmethyl)phenoxy]butyl]-1,2,4-triazole-3,5-diamine Openeye Name: 1-[4-[3-(1-piperidylmethyl)phenoxy]butyl]-1,2,4-triazole-3,5-diamine CAS Name: 1-[4-[3-(1-piperidinylmethyl)phenoxy]butyl]-1,2,4-triazole-3,5-diamine IUPAC Name: 1-[4-[3-(piperidin-1-ylmethyl)phenoxy]butyl]-1,2,4-triazole-3,5-diamine Traditional Name: [5-amino-1-[4-[3-(piperidinomethyl)phenoxy]butyl]-1,2,4-triazol-3-yl]amine Formula: C18H28N6O MolecularWeight: 344.45452

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CC2=CC(=CC=C2)OCCCCN3C(=NC(=N3)N)N

Isomeric SMILES

C1CCN(CC1)CC2=CC(=CC=C2)OCCCCN3C(=NC(=N3)N)N

InChI

InChI=1S/C18H28N6O/c19-17-21-18(20)24(22-17)11-4-5-12-25-16-8-6-7-15(13-16)14-23-9-2-1-3-10-23/h6-8,13H,1-5,9-12,14H2,(H4,19,20,21,22)