N-[3-[3-(dimethylaminomethyl)phenoxy]propyl]-5-phenyl-1H-1,2,4-triazol-3-amine

Systemtic Name: N-[3-[3-(dimethylaminomethyl)phenoxy]propyl]-5-phenyl-1H-1,2,4-triazol-3-amine Openeye Name: N-[3-[3-(dimethylaminomethyl)phenoxy]propyl]-5-phenyl-1H-1,2,4-triazol-3-amine CAS Name: N-[3-[3-(dimethylaminomethyl)phenoxy]propyl]-5-phenyl-1H-1,2,4-triazol-3-amine IUPAC Name: N-[3-[3-(dimethylaminomethyl)phenoxy]propyl]-5-phenyl-1H-1,2,4-triazol-3-amine Traditional Name: dimethyl-[3-[3-[(5-phenyl-1H-1,2,4-triazol-3-yl)amino]propoxy]benzyl]amine Formula: C20H25N5O MolecularWeight: 351.4454

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC1=CC(=CC=C1)OCCCNC2=NNC(=N2)C3=CC=CC=C3

Isomeric SMILES

CN(C)CC1=CC(=CC=C1)OCCCNC2=NNC(=N2)C3=CC=CC=C3

InChI

InChI=1S/C20H25N5O/c1-25(2)15-16-8-6-11-18(14-16)26-13-7-12-21-20-22-19(23-24-20)17-9-4-3-5-10-17/h3-6,8-11,14H,7,12-13,15H2,1-2H3,(H2,21,22,23,24)