2-[1-(3-chlorophenyl)-1,2,4-triazol-3-yl]-N-(pyridin-4-ylmethyl)aniline

Systemtic Name: 2-[1-(3-chlorophenyl)-1,2,4-triazol-3-yl]-N-(pyridin-4-ylmethyl)aniline Openeye Name: 2-[1-(3-chlorophenyl)-1,2,4-triazol-3-yl]-N-(4-pyridylmethyl)aniline CAS Name: 2-[1-(3-chlorophenyl)-1,2,4-triazol-3-yl]-N-(pyridin-4-ylmethyl)aniline IUPAC Name: 2-[1-(3-chlorophenyl)-1,2,4-triazol-3-yl]-N-(pyridin-4-ylmethyl)aniline Traditional Name: [2-[1-(3-chlorophenyl)-1,2,4-triazol-3-yl]phenyl]-(4-pyridylmethyl)amine Formula: C20H16ClN5 MolecularWeight: 361.82754

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C2=NN(C=N2)C3=CC(=CC=C3)Cl)NCC4=CC=NC=C4

Isomeric SMILES

C1=CC=C(C(=C1)C2=NN(C=N2)C3=CC(=CC=C3)Cl)NCC4=CC=NC=C4

InChI

InChI=1S/C20H16ClN5/c21-16-4-3-5-17(12-16)26-14-24-20(25-26)18-6-1-2-7-19(18)23-13-15-8-10-22-11-9-15/h1-12,14,23H,13H2