N-(3,7-dimethyl-5-oxidanylidene-8H-[1,3]thiazolo[3,2-a]pyrimidin-4-ium-6-yl)-4-iodanyl-benzamide

Systemtic Name: N-(3,7-dimethyl-5-oxidanylidene-8H-[1,3]thiazolo[3,2-a]pyrimidin-4-ium-6-yl)-4-iodanyl-benzamide Openeye Name: N-(3,7-dimethyl-5-oxo-8H-thiazolo[3,2-a]pyrimidin-4-ium-6-yl)-4-iodo-benzamide CAS Name: N-(3,7-dimethyl-5-oxo-8H-thiazolo[3,2-a]pyrimidin-4-ium-6-yl)-4-iodobenzamide IUPAC Name: N-(3,7-dimethyl-5-oxo-8H-[1,3]thiazolo[3,2-a]pyrimidin-4-ium-6-yl)-4-iodobenzamide Traditional Name: 4-iodo-N-(5-keto-3,7-dimethyl-8H-thiazolo[3,2-a]pyrimidin-4-ium-6-yl)benzamide Formula: C15H13IN3O2S+ MolecularWeight: 426.25209

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC2=[N+]1C(=O)C(=C(N2)C)NC(=O)C3=CC=C(C=C3)I

Isomeric SMILES

CC1=CSC2=[N+]1C(=O)C(=C(N2)C)NC(=O)C3=CC=C(C=C3)I

InChI

InChI=1S/C15H12IN3O2S/c1-8-7-22-15-17-9(2)12(14(21)19(8)15)18-13(20)10-3-5-11(16)6-4-10/h3-7H,1-2H3,(H,18,20)/p+1