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

Systemtic Name: 3-[3-(pyrrolidin-1-ylmethyl)phenyl]-5-(4-pyrrol-1-ylphenyl)-1H-1,2,4-triazole Openeye Name: 3-[3-(pyrrolidin-1-ylmethyl)phenyl]-5-(4-pyrrol-1-ylphenyl)-1H-1,2,4-triazole CAS Name: 3-[3-(1-pyrrolidinylmethyl)phenyl]-5-[4-(1-pyrrolyl)phenyl]-1H-1,2,4-triazole IUPAC Name: 3-[3-(pyrrolidin-1-ylmethyl)phenyl]-5-(4-pyrrol-1-ylphenyl)-1H-1,2,4-triazole Traditional Name: 3-[3-(pyrrolidinomethyl)phenyl]-5-(4-pyrrol-1-ylphenyl)-1H-1,2,4-triazole Formula: C23H23N5 MolecularWeight: 369.46222

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CC2=CC=CC(=C2)C3=NNC(=N3)C4=CC=C(C=C4)N5C=CC=C5

Isomeric SMILES

C1CCN(C1)CC2=CC=CC(=C2)C3=NNC(=N3)C4=CC=C(C=C4)N5C=CC=C5

InChI

InChI=1S/C23H23N5/c1-2-13-27(12-1)17-18-6-5-7-20(16-18)23-24-22(25-26-23)19-8-10-21(11-9-19)28-14-3-4-15-28/h3-11,14-16H,1-2,12-13,17H2,(H,24,25,26)