2-methylsulfanyl-N-[3-[4-(6-oxidanylidene-1H-pyridazin-3-yl)phenyl]propyl]ethanesulfonamide

Systemtic Name: 2-methylsulfanyl-N-[3-[4-(6-oxidanylidene-1H-pyridazin-3-yl)phenyl]propyl]ethanesulfonamide Openeye Name: 2-methylsulfanyl-N-[3-[4-(6-oxo-1H-pyridazin-3-yl)phenyl]propyl]ethanesulfonamide CAS Name: 2-(methylthio)-N-[3-[4-(6-oxo-1H-pyridazin-3-yl)phenyl]propyl]ethanesulfonamide IUPAC Name: 2-methylsulfanyl-N-[3-[4-(6-oxo-1H-pyridazin-3-yl)phenyl]propyl]ethanesulfonamide Traditional Name: N-[3-[4-(6-keto-1H-pyridazin-3-yl)phenyl]propyl]-2-(methylthio)ethanesulfonamide Formula: C16H21N3O3S2 MolecularWeight: 367.48624

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Descriptors Computed from Structure

Canonical SMILES:

CSCCS(=O)(=O)NCCCC1=CC=C(C=C1)C2=NNC(=O)C=C2

Isomeric SMILES

CSCCS(=O)(=O)NCCCC1=CC=C(C=C1)C2=NNC(=O)C=C2

InChI

InChI=1S/C16H21N3O3S2/c1-23-11-12-24(21,22)17-10-2-3-13-4-6-14(7-5-13)15-8-9-16(20)19-18-15/h4-9,17H,2-3,10-12H2,1H3,(H,19,20)