2,3-dimethyl-N-(3-methylbutyl)-5-oxidanylidene-8H-[1,3]thiazolo[3,2-a]pyrimidin-4-ium-6-carboxamide

Systemtic Name: 2,3-dimethyl-N-(3-methylbutyl)-5-oxidanylidene-8H-[1,3]thiazolo[3,2-a]pyrimidin-4-ium-6-carboxamide Openeye Name: N-isopentyl-2,3-dimethyl-5-oxo-8H-thiazolo[3,2-a]pyrimidin-4-ium-6-carboxamide CAS Name: 2,3-dimethyl-N-(3-methylbutyl)-5-oxo-8H-thiazolo[3,2-a]pyrimidin-4-ium-6-carboxamide IUPAC Name: 2,3-dimethyl-N-(3-methylbutyl)-5-oxo-8H-[1,3]thiazolo[3,2-a]pyrimidin-4-ium-6-carboxamide Traditional Name: N-isoamyl-5-keto-2,3-dimethyl-8H-thiazolo[3,2-a]pyrimidin-4-ium-6-carboxamide Formula: C14H20N3O2S+ MolecularWeight: 294.3925

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=[N+]1C(=O)C(=CN2)C(=O)NCCC(C)C)C

Isomeric SMILES

CC1=C(SC2=[N+]1C(=O)C(=CN2)C(=O)NCCC(C)C)C

InChI

InChI=1S/C14H19N3O2S/c1-8(2)5-6-15-12(18)11-7-16-14-17(13(11)19)9(3)10(4)20-14/h7-8H,5-6H2,1-4H3,(H,15,18)/p+1