3-(3-bromanyl-4-methyl-phenyl)-5-pyridin-2-ylsulfanyl-4,5-dihydro-1H-pyridazin-6-one

Systemtic Name: 3-(3-bromanyl-4-methyl-phenyl)-5-pyridin-2-ylsulfanyl-4,5-dihydro-1H-pyridazin-6-one Openeye Name: 3-(3-bromo-4-methyl-phenyl)-5-(2-pyridylsulfanyl)-4,5-dihydro-1H-pyridazin-6-one CAS Name: 3-(3-bromo-4-methylphenyl)-5-(2-pyridinylthio)-4,5-dihydro-1H-pyridazin-6-one IUPAC Name: 3-(3-bromo-4-methylphenyl)-5-pyridin-2-ylsulfanyl-4,5-dihydro-1H-pyridazin-6-one Traditional Name: 3-(3-bromo-4-methyl-phenyl)-5-(2-pyridylthio)-4,5-dihydro-1H-pyridazin-6-one Formula: C16H14BrN3OS MolecularWeight: 376.27086

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NNC(=O)C(C2)SC3=CC=CC=N3)Br

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NNC(=O)C(C2)SC3=CC=CC=N3)Br

InChI

InChI=1S/C16H14BrN3OS/c1-10-5-6-11(8-12(10)17)13-9-14(16(21)20-19-13)22-15-4-2-3-7-18-15/h2-8,14H,9H2,1H3,(H,20,21)