5-[3-(3-bromophenyl)-1H-1,2,4-triazol-5-yl]-N-(pyridin-4-ylmethyl)-1H-pyrazol-4-amine

Systemtic Name: 5-[3-(3-bromophenyl)-1H-1,2,4-triazol-5-yl]-N-(pyridin-4-ylmethyl)-1H-pyrazol-4-amine Openeye Name: 5-[3-(3-bromophenyl)-1H-1,2,4-triazol-5-yl]-N-(4-pyridylmethyl)-1H-pyrazol-4-amine CAS Name: 5-[3-(3-bromophenyl)-1H-1,2,4-triazol-5-yl]-N-(pyridin-4-ylmethyl)-1H-pyrazol-4-amine IUPAC Name: 5-[3-(3-bromophenyl)-1H-1,2,4-triazol-5-yl]-N-(pyridin-4-ylmethyl)-1H-pyrazol-4-amine Traditional Name: [5-[3-(3-bromophenyl)-1H-1,2,4-triazol-5-yl]-1H-pyrazol-4-yl]-(4-pyridylmethyl)amine Formula: C17H14BrN7 MolecularWeight: 396.24396

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Br)C2=NNC(=N2)C3=C(C=NN3)NCC4=CC=NC=C4

Isomeric SMILES

C1=CC(=CC(=C1)Br)C2=NNC(=N2)C3=C(C=NN3)NCC4=CC=NC=C4

InChI

InChI=1S/C17H14BrN7/c18-13-3-1-2-12(8-13)16-22-17(25-24-16)15-14(10-21-23-15)20-9-11-4-6-19-7-5-11/h1-8,10,20H,9H2,(H,21,23)(H,22,24,25)