N-(2,5-dimethylphenyl)-4-[3-(4-methylphenyl)sulfanyl-6-oxidanylidene-pyridazin-1-yl]benzamide

Systemtic Name: N-(2,5-dimethylphenyl)-4-[3-(4-methylphenyl)sulfanyl-6-oxidanylidene-pyridazin-1-yl]benzamide Openeye Name: N-(2,5-dimethylphenyl)-4-[6-oxo-3-(p-tolylsulfanyl)pyridazin-1-yl]benzamide CAS Name: N-(2,5-dimethylphenyl)-4-[3-[(4-methylphenyl)thio]-6-oxo-1-pyridazinyl]benzamide IUPAC Name: N-(2,5-dimethylphenyl)-4-[3-(4-methylphenyl)sulfanyl-6-oxopyridazin-1-yl]benzamide Traditional Name: N-(2,5-dimethylphenyl)-4-[6-keto-3-(p-tolylthio)pyridazin-1-yl]benzamide Formula: C26H23N3O2S MolecularWeight: 441.54472

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC2=NN(C(=O)C=C2)C3=CC=C(C=C3)C(=O)NC4=C(C=CC(=C4)C)C

Isomeric SMILES

CC1=CC=C(C=C1)SC2=NN(C(=O)C=C2)C3=CC=C(C=C3)C(=O)NC4=C(C=CC(=C4)C)C

InChI

InChI=1S/C26H23N3O2S/c1-17-5-12-22(13-6-17)32-24-14-15-25(30)29(28-24)21-10-8-20(9-11-21)26(31)27-23-16-18(2)4-7-19(23)3/h4-16H,1-3H3,(H,27,31)