6-methyl-3-[(2-sulfanylidene-1,3-benzothiazol-3-yl)methylsulfanyl]-2H-1,2,4-triazin-5-one

Systemtic Name: 6-methyl-3-[(2-sulfanylidene-1,3-benzothiazol-3-yl)methylsulfanyl]-2H-1,2,4-triazin-5-one Openeye Name: 6-methyl-3-[(2-thioxo-1,3-benzothiazol-3-yl)methylsulfanyl]-2H-1,2,4-triazin-5-one CAS Name: 6-methyl-3-[(2-sulfanylidene-1,3-benzothiazol-3-yl)methylthio]-2H-1,2,4-triazin-5-one IUPAC Name: 6-methyl-3-[(2-sulfanylidene-1,3-benzothiazol-3-yl)methylsulfanyl]-2H-1,2,4-triazin-5-one Traditional Name: 6-methyl-3-[(2-thioxo-1,3-benzothiazol-3-yl)methylthio]-2H-1,2,4-triazin-5-one Formula: C12H10N4OS3 MolecularWeight: 322.429

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NNC(=NC1=O)SCN2C3=CC=CC=C3SC2=S

Isomeric SMILES

CC1=NNC(=NC1=O)SCN2C3=CC=CC=C3SC2=S

InChI

InChI=1S/C12H10N4OS3/c1-7-10(17)13-11(15-14-7)19-6-16-8-4-2-3-5-9(8)20-12(16)18/h2-5H,6H2,1H3,(H,13,15,17)