N-[(4-methoxyphenyl)methyl]-4-[3-(4-methylphenyl)sulfanyl-6-oxidanylidene-pyridazin-1-yl]benzamide

Systemtic Name: N-[(4-methoxyphenyl)methyl]-4-[3-(4-methylphenyl)sulfanyl-6-oxidanylidene-pyridazin-1-yl]benzamide Openeye Name: N-[(4-methoxyphenyl)methyl]-4-[6-oxo-3-(p-tolylsulfanyl)pyridazin-1-yl]benzamide CAS Name: N-[(4-methoxyphenyl)methyl]-4-[3-[(4-methylphenyl)thio]-6-oxo-1-pyridazinyl]benzamide IUPAC Name: N-[(4-methoxyphenyl)methyl]-4-[3-(4-methylphenyl)sulfanyl-6-oxopyridazin-1-yl]benzamide Traditional Name: 4-[6-keto-3-(p-tolylthio)pyridazin-1-yl]-N-p-anisyl-benzamide Formula: C26H23N3O3S MolecularWeight: 457.54412

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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)NCC4=CC=C(C=C4)OC

Isomeric SMILES

CC1=CC=C(C=C1)SC2=NN(C(=O)C=C2)C3=CC=C(C=C3)C(=O)NCC4=CC=C(C=C4)OC

InChI

InChI=1S/C26H23N3O3S/c1-18-3-13-23(14-4-18)33-24-15-16-25(30)29(28-24)21-9-7-20(8-10-21)26(31)27-17-19-5-11-22(32-2)12-6-19/h3-16H,17H2,1-2H3,(H,27,31)