2-(1,3-benzothiazol-2-ylsulfanyl)-N-[3-(6-oxidanylidenepyridazin-1-yl)propyl]ethanamide

Systemtic Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-N-[3-(6-oxidanylidenepyridazin-1-yl)propyl]ethanamide Openeye Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-N-[3-(6-oxopyridazin-1-yl)propyl]acetamide CAS Name: 2-(1,3-benzothiazol-2-ylthio)-N-[3-(6-oxo-1-pyridazinyl)propyl]acetamide IUPAC Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-N-[3-(6-oxopyridazin-1-yl)propyl]acetamide Traditional Name: 2-(1,3-benzothiazol-2-ylthio)-N-[3-(6-ketopyridazin-1-yl)propyl]acetamide Formula: C16H16N4O2S2 MolecularWeight: 360.45384

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)SCC(=O)NCCCN3C(=O)C=CC=N3

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)SCC(=O)NCCCN3C(=O)C=CC=N3

InChI

InChI=1S/C16H16N4O2S2/c21-14(17-8-4-10-20-15(22)7-3-9-18-20)11-23-16-19-12-5-1-2-6-13(12)24-16/h1-3,5-7,9H,4,8,10-11H2,(H,17,21)