N-[4-(4-methyl-6-oxidanylidene-4,5-dihydro-1H-pyridazin-3-yl)phenyl]-2-(sulfanylmethyl)butanamide

Systemtic Name: N-[4-(4-methyl-6-oxidanylidene-4,5-dihydro-1H-pyridazin-3-yl)phenyl]-2-(sulfanylmethyl)butanamide Openeye Name: N-[4-(4-methyl-6-oxo-4,5-dihydro-1H-pyridazin-3-yl)phenyl]-2-(sulfanylmethyl)butanamide CAS Name: 2-(mercaptomethyl)-N-[4-(4-methyl-6-oxo-4,5-dihydro-1H-pyridazin-3-yl)phenyl]butanamide IUPAC Name: N-[4-(4-methyl-6-oxo-4,5-dihydro-1H-pyridazin-3-yl)phenyl]-2-(sulfanylmethyl)butanamide Traditional Name: N-[4-(6-keto-4-methyl-4,5-dihydro-1H-pyridazin-3-yl)phenyl]-2-(mercaptomethyl)butyramide Formula: C16H21N3O2S MolecularWeight: 319.42184

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CS)C(=O)NC1=CC=C(C=C1)C2=NNC(=O)CC2C

Isomeric SMILES

CCC(CS)C(=O)NC1=CC=C(C=C1)C2=NNC(=O)CC2C

InChI

InChI=1S/C16H21N3O2S/c1-3-11(9-22)16(21)17-13-6-4-12(5-7-13)15-10(2)8-14(20)18-19-15/h4-7,10-11,22H,3,8-9H2,1-2H3,(H,17,21)(H,18,20)