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

Systemtic Name: N-[(4-ethylphenyl)methyl]-4-[3-(4-methylphenyl)sulfanyl-6-oxidanylidene-pyridazin-1-yl]benzamide Openeye Name: N-[(4-ethylphenyl)methyl]-4-[6-oxo-3-(p-tolylsulfanyl)pyridazin-1-yl]benzamide CAS Name: N-[(4-ethylphenyl)methyl]-4-[3-[(4-methylphenyl)thio]-6-oxo-1-pyridazinyl]benzamide IUPAC Name: N-[(4-ethylphenyl)methyl]-4-[3-(4-methylphenyl)sulfanyl-6-oxopyridazin-1-yl]benzamide Traditional Name: N-(4-ethylbenzyl)-4-[6-keto-3-(p-tolylthio)pyridazin-1-yl]benzamide Formula: C27H25N3O2S MolecularWeight: 455.5713

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)CNC(=O)C2=CC=C(C=C2)N3C(=O)C=CC(=N3)SC4=CC=C(C=C4)C

Isomeric SMILES

CCC1=CC=C(C=C1)CNC(=O)C2=CC=C(C=C2)N3C(=O)C=CC(=N3)SC4=CC=C(C=C4)C

InChI

InChI=1S/C27H25N3O2S/c1-3-20-6-8-21(9-7-20)18-28-27(32)22-10-12-23(13-11-22)30-26(31)17-16-25(29-30)33-24-14-4-19(2)5-15-24/h4-17H,3,18H2,1-2H3,(H,28,32)