2-methyl-3-(1-oxidanylidenephthalazin-2-yl)propanethioamide

Systemtic Name: 2-methyl-3-(1-oxidanylidenephthalazin-2-yl)propanethioamide Openeye Name: 2-methyl-3-(1-oxophthalazin-2-yl)propanethioamide CAS Name: 2-methyl-3-(1-oxo-2-phthalazinyl)propanethioamide IUPAC Name: 2-methyl-3-(1-oxophthalazin-2-yl)propanethioamide Traditional Name: 3-(1-ketophthalazin-2-yl)-2-methyl-thiopropionamide Formula: C12H13N3OS MolecularWeight: 247.31612

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Descriptors Computed from Structure

Canonical SMILES:

CC(CN1C(=O)C2=CC=CC=C2C=N1)C(=S)N

Isomeric SMILES

CC(CN1C(=O)C2=CC=CC=C2C=N1)C(=S)N

InChI

InChI=1S/C12H13N3OS/c1-8(11(13)17)7-15-12(16)10-5-3-2-4-9(10)6-14-15/h2-6,8H,7H2,1H3,(H2,13,17)