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

Systemtic Name: 5-bromanyl-3-[4-(4-chlorophenyl)-3-methyl-butoxy]-4-(pyridin-3-ylmethylamino)-1H-pyridazin-6-one Openeye Name: 5-bromo-3-[4-(4-chlorophenyl)-3-methyl-butoxy]-4-(3-pyridylmethylamino)-1H-pyridazin-6-one CAS Name: 5-bromo-3-[4-(4-chlorophenyl)-3-methylbutoxy]-4-(3-pyridinylmethylamino)-1H-pyridazin-6-one IUPAC Name: 5-bromo-3-[4-(4-chlorophenyl)-3-methylbutoxy]-4-(pyridin-3-ylmethylamino)-1H-pyridazin-6-one Traditional Name: 5-bromo-3-[4-(4-chlorophenyl)-3-methyl-butoxy]-4-(3-pyridylmethylamino)-1H-pyridazin-6-one Formula: C21H22BrClN4O2 MolecularWeight: 477.78198

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCOC1=NNC(=O)C(=C1NCC2=CN=CC=C2)Br)CC3=CC=C(C=C3)Cl

Isomeric SMILES

CC(CCOC1=NNC(=O)C(=C1NCC2=CN=CC=C2)Br)CC3=CC=C(C=C3)Cl

InChI

InChI=1S/C21H22BrClN4O2/c1-14(11-15-4-6-17(23)7-5-15)8-10-29-21-19(18(22)20(28)26-27-21)25-13-16-3-2-9-24-12-16/h2-7,9,12,14H,8,10-11,13H2,1H3,(H2,25,26,28)