2-(5-cyano-3,4-dimethyl-6-oxidanylidene-pyridazin-1-yl)-N-[2-(phenylmethylsulfanyl)ethyl]ethanamide

Systemtic Name: 2-(5-cyano-3,4-dimethyl-6-oxidanylidene-pyridazin-1-yl)-N-[2-(phenylmethylsulfanyl)ethyl]ethanamide Openeye Name: N-(2-benzylsulfanylethyl)-2-(5-cyano-3,4-dimethyl-6-oxo-pyridazin-1-yl)acetamide CAS Name: 2-(5-cyano-3,4-dimethyl-6-oxo-1-pyridazinyl)-N-[2-(phenylmethylthio)ethyl]acetamide IUPAC Name: N-(2-benzylsulfanylethyl)-2-(5-cyano-3,4-dimethyl-6-oxopyridazin-1-yl)acetamide Traditional Name: N-[2-(benzylthio)ethyl]-2-(5-cyano-6-keto-3,4-dimethyl-pyridazin-1-yl)acetamide Formula: C18H20N4O2S MolecularWeight: 356.442

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N=C1C)CC(=O)NCCSCC2=CC=CC=C2)C#N

Isomeric SMILES

CC1=C(C(=O)N(N=C1C)CC(=O)NCCSCC2=CC=CC=C2)C#N

InChI

InChI=1S/C18H20N4O2S/c1-13-14(2)21-22(18(24)16(13)10-19)11-17(23)20-8-9-25-12-15-6-4-3-5-7-15/h3-7H,8-9,11-12H2,1-2H3,(H,20,23)