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

Systemtic Name: N-(4-benzamido-2,5-dimethoxy-phenyl)-5-oxidanylidene-8H-[1,3]thiazolo[3,2-a]pyrimidin-4-ium-6-carboxamide Openeye Name: N-(4-benzamido-2,5-dimethoxy-phenyl)-5-oxo-8H-thiazolo[3,2-a]pyrimidin-4-ium-6-carboxamide CAS Name: N-(4-benzamido-2,5-dimethoxyphenyl)-5-oxo-8H-thiazolo[3,2-a]pyrimidin-4-ium-6-carboxamide IUPAC Name: N-(4-benzamido-2,5-dimethoxyphenyl)-5-oxo-8H-[1,3]thiazolo[3,2-a]pyrimidin-4-ium-6-carboxamide Traditional Name: N-(4-benzamido-2,5-dimethoxy-phenyl)-5-keto-8H-thiazolo[3,2-a]pyrimidin-4-ium-6-carboxamide Formula: C22H19N4O5S+ MolecularWeight: 451.47506

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1NC(=O)C2=CC=CC=C2)OC)NC(=O)C3=CNC4=[N+](C3=O)C=CS4

Isomeric SMILES

COC1=CC(=C(C=C1NC(=O)C2=CC=CC=C2)OC)NC(=O)C3=CNC4=[N+](C3=O)C=CS4

InChI

InChI=1S/C22H18N4O5S/c1-30-17-11-16(25-20(28)14-12-23-22-26(21(14)29)8-9-32-22)18(31-2)10-15(17)24-19(27)13-6-4-3-5-7-13/h3-12H,1-2H3,(H2,24,25,27,28)/p+1