5-naphthalen-2-yl-3-[3-(pyrrolidin-1-ylmethyl)phenyl]-1H-1,2,4-triazole hydrochloride

Systemtic Name: 5-naphthalen-2-yl-3-[3-(pyrrolidin-1-ylmethyl)phenyl]-1H-1,2,4-triazole hydrochloride Openeye Name: 5-(2-naphthyl)-3-[3-(pyrrolidin-1-ylmethyl)phenyl]-1H-1,2,4-triazole hydrochloride CAS Name: 5-(2-naphthalenyl)-3-[3-(1-pyrrolidinylmethyl)phenyl]-1H-1,2,4-triazole hydrochloride IUPAC Name: 5-naphthalen-2-yl-3-[3-(pyrrolidin-1-ylmethyl)phenyl]-1H-1,2,4-triazole hydrochloride Traditional Name: 5-(2-naphthyl)-3-[3-(pyrrolidinomethyl)phenyl]-1H-1,2,4-triazole hydrochloride Formula: C23H23ClN4 MolecularWeight: 390.90852

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CC2=CC=CC(=C2)C3=NNC(=N3)C4=CC5=CC=CC=C5C=C4.Cl

Isomeric SMILES

C1CCN(C1)CC2=CC=CC(=C2)C3=NNC(=N3)C4=CC5=CC=CC=C5C=C4.Cl

InChI

InChI=1S/C23H22N4.ClH/c1-2-8-19-15-21(11-10-18(19)7-1)23-24-22(25-26-23)20-9-5-6-17(14-20)16-27-12-3-4-13-27;/h1-2,5-11,14-15H,3-4,12-13,16H2,(H,24,25,26);1H