2-methyl-3-(4-oxidanylidene-1,2,3-benzotriazin-3-yl)propanethioamide

Systemtic Name: 2-methyl-3-(4-oxidanylidene-1,2,3-benzotriazin-3-yl)propanethioamide Openeye Name: 2-methyl-3-(4-oxo-1,2,3-benzotriazin-3-yl)propanethioamide CAS Name: 2-methyl-3-(4-oxo-1,2,3-benzotriazin-3-yl)propanethioamide IUPAC Name: 2-methyl-3-(4-oxo-1,2,3-benzotriazin-3-yl)propanethioamide Traditional Name: 3-(4-keto-1,2,3-benzotriazin-3-yl)-2-methyl-thiopropionamide Formula: C11H12N4OS MolecularWeight: 248.30418

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Descriptors Computed from Structure

Canonical SMILES:

CC(CN1C(=O)C2=CC=CC=C2N=N1)C(=S)N

Isomeric SMILES

CC(CN1C(=O)C2=CC=CC=C2N=N1)C(=S)N

InChI

InChI=1S/C11H12N4OS/c1-7(10(12)17)6-15-11(16)8-4-2-3-5-9(8)13-14-15/h2-5,7H,6H2,1H3,(H2,12,17)