N-[4-(4-bromophenyl)sulfanylphenyl]-1-(2-methoxyethyl)-6-oxidanylidene-pyridazine-3-carboxamide

Systemtic Name: N-[4-(4-bromophenyl)sulfanylphenyl]-1-(2-methoxyethyl)-6-oxidanylidene-pyridazine-3-carboxamide Openeye Name: N-[4-(4-bromophenyl)sulfanylphenyl]-1-(2-methoxyethyl)-6-oxo-pyridazine-3-carboxamide CAS Name: N-[4-[(4-bromophenyl)thio]phenyl]-1-(2-methoxyethyl)-6-oxo-3-pyridazinecarboxamide IUPAC Name: N-[4-(4-bromophenyl)sulfanylphenyl]-1-(2-methoxyethyl)-6-oxopyridazine-3-carboxamide Traditional Name: N-[4-[(4-bromophenyl)thio]phenyl]-6-keto-1-(2-methoxyethyl)pyridazine-3-carboxamide Formula: C20H18BrN3O3S MolecularWeight: 460.34422

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Descriptors Computed from Structure

Canonical SMILES:

COCCN1C(=O)C=CC(=N1)C(=O)NC2=CC=C(C=C2)SC3=CC=C(C=C3)Br

Isomeric SMILES

COCCN1C(=O)C=CC(=N1)C(=O)NC2=CC=C(C=C2)SC3=CC=C(C=C3)Br

InChI

InChI=1S/C20H18BrN3O3S/c1-27-13-12-24-19(25)11-10-18(23-24)20(26)22-15-4-8-17(9-5-15)28-16-6-2-14(21)3-7-16/h2-11H,12-13H2,1H3,(H,22,26)