1,6-dimethyl-3-(phenylmethylsulfanyl)pyridazino[4,5-e][1,3,4]thiadiazin-5-one

Systemtic Name: 1,6-dimethyl-3-(phenylmethylsulfanyl)pyridazino[4,5-e][1,3,4]thiadiazin-5-one Openeye Name: 3-benzylsulfanyl-1,6-dimethyl-pyridazino[4,5-e][1,3,4]thiadiazin-5-one CAS Name: 1,6-dimethyl-3-(phenylmethylthio)-5-pyridazino[4,5-e][1,3,4]thiadiazinone IUPAC Name: 3-benzylsulfanyl-1,6-dimethylpyridazino[4,5-e][1,3,4]thiadiazin-5-one Traditional Name: 3-(benzylthio)-1,6-dimethyl-pyridazino[4,5-e][1,3,4]thiadiazin-5-one Formula: C14H14N4OS2 MolecularWeight: 318.41716

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(N=C2)C)SC(=N1)SCC3=CC=CC=C3

Isomeric SMILES

CN1C2=C(C(=O)N(N=C2)C)SC(=N1)SCC3=CC=CC=C3

InChI

InChI=1S/C14H14N4OS2/c1-17-11-8-15-18(2)13(19)12(11)21-14(16-17)20-9-10-6-4-3-5-7-10/h3-8H,9H2,1-2H3