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

Systemtic Name: 2,3-dimethyl-N-(2-methylpropyl)-5-oxidanylidene-8H-[1,3]thiazolo[3,2-a]pyrimidin-4-ium-6-carboxamide Openeye Name: N-isobutyl-2,3-dimethyl-5-oxo-8H-thiazolo[3,2-a]pyrimidin-4-ium-6-carboxamide CAS Name: 2,3-dimethyl-N-(2-methylpropyl)-5-oxo-8H-thiazolo[3,2-a]pyrimidin-4-ium-6-carboxamide IUPAC Name: 2,3-dimethyl-N-(2-methylpropyl)-5-oxo-8H-[1,3]thiazolo[3,2-a]pyrimidin-4-ium-6-carboxamide Traditional Name: N-isobutyl-5-keto-2,3-dimethyl-8H-thiazolo[3,2-a]pyrimidin-4-ium-6-carboxamide Formula: C13H18N3O2S+ MolecularWeight: 280.36592

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H17N3O2S/c1-7(2)5-14-11(17)10-6-15-13-16(12(10)18)8(3)9(4)19-13/h6-7H,5H2,1-4H3,(H,14,17)/p+1