N-[4-(4-bromophenyl)sulfanylphenyl]-1-methyl-6-oxidanylidene-pyridazine-3-carboxamide

Systemtic Name: N-[4-(4-bromophenyl)sulfanylphenyl]-1-methyl-6-oxidanylidene-pyridazine-3-carboxamide Openeye Name: N-[4-(4-bromophenyl)sulfanylphenyl]-1-methyl-6-oxo-pyridazine-3-carboxamide CAS Name: N-[4-[(4-bromophenyl)thio]phenyl]-1-methyl-6-oxo-3-pyridazinecarboxamide IUPAC Name: N-[4-(4-bromophenyl)sulfanylphenyl]-1-methyl-6-oxopyridazine-3-carboxamide Traditional Name: N-[4-[(4-bromophenyl)thio]phenyl]-6-keto-1-methyl-pyridazine-3-carboxamide Formula: C18H14BrN3O2S MolecularWeight: 416.29166

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C=CC(=N1)C(=O)NC2=CC=C(C=C2)SC3=CC=C(C=C3)Br

Isomeric SMILES

CN1C(=O)C=CC(=N1)C(=O)NC2=CC=C(C=C2)SC3=CC=C(C=C3)Br

InChI

InChI=1S/C18H14BrN3O2S/c1-22-17(23)11-10-16(21-22)18(24)20-13-4-8-15(9-5-13)25-14-6-2-12(19)3-7-14/h2-11H,1H3,(H,20,24)