3-methyl-N-(4-oxidanylidene-1H-pyrimido[2,1-b][1,3]benzothiazol-5-ium-3-yl)benzamide

Systemtic Name: 3-methyl-N-(4-oxidanylidene-1H-pyrimido[2,1-b][1,3]benzothiazol-5-ium-3-yl)benzamide Openeye Name: 3-methyl-N-(4-oxo-1H-pyrimido[2,1-b][1,3]benzothiazol-5-ium-3-yl)benzamide CAS Name: 3-methyl-N-(4-oxo-1H-pyrimido[2,1-b][1,3]benzothiazol-5-ium-3-yl)benzamide IUPAC Name: 3-methyl-N-(4-oxo-1H-pyrimido[2,1-b][1,3]benzothiazol-5-ium-3-yl)benzamide Traditional Name: N-(4-keto-1H-pyrimido[2,1-b][1,3]benzothiazol-5-ium-3-yl)-3-methyl-benzamide Formula: C18H14N3O2S+ MolecularWeight: 336.38766

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)NC2=CNC3=[N+](C2=O)C4=CC=CC=C4S3

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)NC2=CNC3=[N+](C2=O)C4=CC=CC=C4S3

InChI

InChI=1S/C18H13N3O2S/c1-11-5-4-6-12(9-11)16(22)20-13-10-19-18-21(17(13)23)14-7-2-3-8-15(14)24-18/h2-10H,1H3,(H,20,22)/p+1