3-(4,6-dimethyl-2-oxidanylidene-pyrimidin-1-yl)propanethioamide

Systemtic Name: 3-(4,6-dimethyl-2-oxidanylidene-pyrimidin-1-yl)propanethioamide Openeye Name: 3-(4,6-dimethyl-2-oxo-pyrimidin-1-yl)propanethioamide CAS Name: 3-(4,6-dimethyl-2-oxo-1-pyrimidinyl)propanethioamide IUPAC Name: 3-(4,6-dimethyl-2-oxopyrimidin-1-yl)propanethioamide Traditional Name: 3-(2-keto-4,6-dimethyl-pyrimidin-1-yl)thiopropionamide Formula: C9H13N3OS MolecularWeight: 211.28402

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=O)N1CCC(=S)N)C

Isomeric SMILES

CC1=CC(=NC(=O)N1CCC(=S)N)C

InChI

InChI=1S/C9H13N3OS/c1-6-5-7(2)12(9(13)11-6)4-3-8(10)14/h5H,3-4H2,1-2H3,(H2,10,14)