4,5-dimethyl-N-[3-[3-(piperidin-1-ylmethyl)phenoxy]propyl]-1,2,4-triazol-3-amine

Systemtic Name: 4,5-dimethyl-N-[3-[3-(piperidin-1-ylmethyl)phenoxy]propyl]-1,2,4-triazol-3-amine Openeye Name: 4,5-dimethyl-N-[3-[3-(1-piperidylmethyl)phenoxy]propyl]-1,2,4-triazol-3-amine CAS Name: 4,5-dimethyl-N-[3-[3-(1-piperidinylmethyl)phenoxy]propyl]-1,2,4-triazol-3-amine IUPAC Name: 4,5-dimethyl-N-[3-[3-(piperidin-1-ylmethyl)phenoxy]propyl]-1,2,4-triazol-3-amine Traditional Name: (4,5-dimethyl-1,2,4-triazol-3-yl)-[3-[3-(piperidinomethyl)phenoxy]propyl]amine Formula: C19H29N5O MolecularWeight: 343.46646

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N1C)NCCCOC2=CC=CC(=C2)CN3CCCCC3

Isomeric SMILES

CC1=NN=C(N1C)NCCCOC2=CC=CC(=C2)CN3CCCCC3

InChI

InChI=1S/C19H29N5O/c1-16-21-22-19(23(16)2)20-10-7-13-25-18-9-6-8-17(14-18)15-24-11-4-3-5-12-24/h6,8-9,14H,3-5,7,10-13,15H2,1-2H3,(H,20,22)