2-(5-cyano-3,4-dimethyl-6-oxidanylidene-pyridazin-1-yl)-N-(2-phenylsulfanylphenyl)ethanamide

Systemtic Name: 2-(5-cyano-3,4-dimethyl-6-oxidanylidene-pyridazin-1-yl)-N-(2-phenylsulfanylphenyl)ethanamide Openeye Name: 2-(5-cyano-3,4-dimethyl-6-oxo-pyridazin-1-yl)-N-(2-phenylsulfanylphenyl)acetamide CAS Name: 2-(5-cyano-3,4-dimethyl-6-oxo-1-pyridazinyl)-N-[2-(phenylthio)phenyl]acetamide IUPAC Name: 2-(5-cyano-3,4-dimethyl-6-oxopyridazin-1-yl)-N-(2-phenylsulfanylphenyl)acetamide Traditional Name: 2-(5-cyano-6-keto-3,4-dimethyl-pyridazin-1-yl)-N-[2-(phenylthio)phenyl]acetamide Formula: C21H18N4O2S MolecularWeight: 390.45822

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N=C1C)CC(=O)NC2=CC=CC=C2SC3=CC=CC=C3)C#N

Isomeric SMILES

CC1=C(C(=O)N(N=C1C)CC(=O)NC2=CC=CC=C2SC3=CC=CC=C3)C#N

InChI

InChI=1S/C21H18N4O2S/c1-14-15(2)24-25(21(27)17(14)12-22)13-20(26)23-18-10-6-7-11-19(18)28-16-8-4-3-5-9-16/h3-11H,13H2,1-2H3,(H,23,26)