5-bromanyl-3-[3-(4-chlorophenyl)-3-oxidanyl-propoxy]-4-(pyridin-3-ylmethylamino)-1H-pyridazin-6-one

Systemtic Name: 5-bromanyl-3-[3-(4-chlorophenyl)-3-oxidanyl-propoxy]-4-(pyridin-3-ylmethylamino)-1H-pyridazin-6-one Openeye Name: 5-bromo-3-[3-(4-chlorophenyl)-3-hydroxy-propoxy]-4-(3-pyridylmethylamino)-1H-pyridazin-6-one CAS Name: 5-bromo-3-[3-(4-chlorophenyl)-3-hydroxypropoxy]-4-(3-pyridinylmethylamino)-1H-pyridazin-6-one IUPAC Name: 5-bromo-3-[3-(4-chlorophenyl)-3-hydroxypropoxy]-4-(pyridin-3-ylmethylamino)-1H-pyridazin-6-one Traditional Name: 5-bromo-3-[3-(4-chlorophenyl)-3-hydroxy-propoxy]-4-(3-pyridylmethylamino)-1H-pyridazin-6-one Formula: C19H18BrClN4O3 MolecularWeight: 465.72822

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)CNC2=C(C(=O)NN=C2OCCC(C3=CC=C(C=C3)Cl)O)Br

Isomeric SMILES

C1=CC(=CN=C1)CNC2=C(C(=O)NN=C2OCCC(C3=CC=C(C=C3)Cl)O)Br

InChI

InChI=1S/C19H18BrClN4O3/c20-16-17(23-11-12-2-1-8-22-10-12)19(25-24-18(16)27)28-9-7-15(26)13-3-5-14(21)6-4-13/h1-6,8,10,15,26H,7,9,11H2,(H2,23,24,27)