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

Systemtic Name: 5-(2-methoxyphenyl)-3-[3-(pyrrolidin-1-ylmethyl)phenyl]-1H-1,2,4-triazole Openeye Name: 5-(2-methoxyphenyl)-3-[3-(pyrrolidin-1-ylmethyl)phenyl]-1H-1,2,4-triazole CAS Name: 5-(2-methoxyphenyl)-3-[3-(1-pyrrolidinylmethyl)phenyl]-1H-1,2,4-triazole IUPAC Name: 5-(2-methoxyphenyl)-3-[3-(pyrrolidin-1-ylmethyl)phenyl]-1H-1,2,4-triazole Traditional Name: 5-(2-methoxyphenyl)-3-[3-(pyrrolidinomethyl)phenyl]-1H-1,2,4-triazole Formula: C20H22N4O MolecularWeight: 334.41488

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C2=NC(=NN2)C3=CC(=CC=C3)CN4CCCC4

Isomeric SMILES

COC1=CC=CC=C1C2=NC(=NN2)C3=CC(=CC=C3)CN4CCCC4

InChI

InChI=1S/C20H22N4O/c1-25-18-10-3-2-9-17(18)20-21-19(22-23-20)16-8-6-7-15(13-16)14-24-11-4-5-12-24/h2-3,6-10,13H,4-5,11-12,14H2,1H3,(H,21,22,23)