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

Systemtic Name: N-methyl-5-oxidanylidene-3-phenyl-N-(phenylmethyl)-8H-[1,3]thiazolo[3,2-a]pyrimidin-4-ium-6-carboxamide Openeye Name: N-benzyl-N-methyl-5-oxo-3-phenyl-8H-thiazolo[3,2-a]pyrimidin-4-ium-6-carboxamide CAS Name: N-methyl-5-oxo-3-phenyl-N-(phenylmethyl)-8H-thiazolo[3,2-a]pyrimidin-4-ium-6-carboxamide IUPAC Name: N-benzyl-N-methyl-5-oxo-3-phenyl-8H-[1,3]thiazolo[3,2-a]pyrimidin-4-ium-6-carboxamide Traditional Name: N-benzyl-5-keto-N-methyl-3-phenyl-8H-thiazolo[3,2-a]pyrimidin-4-ium-6-carboxamide Formula: C21H18N3O2S+ MolecularWeight: 376.45152

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC=C1)C(=O)C2=CNC3=[N+](C2=O)C(=CS3)C4=CC=CC=C4

Isomeric SMILES

CN(CC1=CC=CC=C1)C(=O)C2=CNC3=[N+](C2=O)C(=CS3)C4=CC=CC=C4

InChI

InChI=1S/C21H17N3O2S/c1-23(13-15-8-4-2-5-9-15)19(25)17-12-22-21-24(20(17)26)18(14-27-21)16-10-6-3-7-11-16/h2-12,14H,13H2,1H3/p+1