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

Systemtic Name: 5-(3-chlorophenyl)-3-[3-(pyrrolidin-1-ylmethyl)phenyl]-1H-1,2,4-triazole Openeye Name: 5-(3-chlorophenyl)-3-[3-(pyrrolidin-1-ylmethyl)phenyl]-1H-1,2,4-triazole CAS Name: 5-(3-chlorophenyl)-3-[3-(1-pyrrolidinylmethyl)phenyl]-1H-1,2,4-triazole IUPAC Name: 5-(3-chlorophenyl)-3-[3-(pyrrolidin-1-ylmethyl)phenyl]-1H-1,2,4-triazole Traditional Name: 5-(3-chlorophenyl)-3-[3-(pyrrolidinomethyl)phenyl]-1H-1,2,4-triazole Formula: C19H19ClN4 MolecularWeight: 338.83396

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H19ClN4/c20-17-8-4-7-16(12-17)19-21-18(22-23-19)15-6-3-5-14(11-15)13-24-9-1-2-10-24/h3-8,11-12H,1-2,9-10,13H2,(H,21,22,23)