4-bromanyl-2-[[[3-(4-chlorophenyl)-5-pyridin-4-yl-1,2,4-triazol-4-yl]amino]methyl]phenol

Systemtic Name: 4-bromanyl-2-[[[3-(4-chlorophenyl)-5-pyridin-4-yl-1,2,4-triazol-4-yl]amino]methyl]phenol Openeye Name: 4-bromo-2-[[[3-(4-chlorophenyl)-5-(4-pyridyl)-1,2,4-triazol-4-yl]amino]methyl]phenol CAS Name: 4-bromo-2-[[[3-(4-chlorophenyl)-5-pyridin-4-yl-1,2,4-triazol-4-yl]amino]methyl]phenol IUPAC Name: 4-bromo-2-[[[3-(4-chlorophenyl)-5-pyridin-4-yl-1,2,4-triazol-4-yl]amino]methyl]phenol Traditional Name: 4-bromo-2-[[[3-(4-chlorophenyl)-5-(4-pyridyl)-1,2,4-triazol-4-yl]amino]methyl]phenol Formula: C20H15BrClN5O MolecularWeight: 456.723

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=NN=C(N2NCC3=C(C=CC(=C3)Br)O)C4=CC=NC=C4)Cl

Isomeric SMILES

C1=CC(=CC=C1C2=NN=C(N2NCC3=C(C=CC(=C3)Br)O)C4=CC=NC=C4)Cl

InChI

InChI=1S/C20H15BrClN5O/c21-16-3-6-18(28)15(11-16)12-24-27-19(13-1-4-17(22)5-2-13)25-26-20(27)14-7-9-23-10-8-14/h1-11,24,28H,12H2