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

Systemtic Name: N-(1,3-benzothiazol-2-ylmethyl)-N-methyl-5-oxidanylidene-8H-[1,3]thiazolo[3,2-a]pyrimidin-4-ium-6-carboxamide Openeye Name: N-(1,3-benzothiazol-2-ylmethyl)-N-methyl-5-oxo-8H-thiazolo[3,2-a]pyrimidin-4-ium-6-carboxamide CAS Name: N-(1,3-benzothiazol-2-ylmethyl)-N-methyl-5-oxo-8H-thiazolo[3,2-a]pyrimidin-4-ium-6-carboxamide IUPAC Name: N-(1,3-benzothiazol-2-ylmethyl)-N-methyl-5-oxo-8H-[1,3]thiazolo[3,2-a]pyrimidin-4-ium-6-carboxamide Traditional Name: N-(1,3-benzothiazol-2-ylmethyl)-5-keto-N-methyl-8H-thiazolo[3,2-a]pyrimidin-4-ium-6-carboxamide Formula: C16H13N4O2S2+ MolecularWeight: 357.43002

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=NC2=CC=CC=C2S1)C(=O)C3=CNC4=[N+](C3=O)C=CS4

Isomeric SMILES

CN(CC1=NC2=CC=CC=C2S1)C(=O)C3=CNC4=[N+](C3=O)C=CS4

InChI

InChI=1S/C16H12N4O2S2/c1-19(9-13-18-11-4-2-3-5-12(11)24-13)14(21)10-8-17-16-20(15(10)22)6-7-23-16/h2-8H,9H2,1H3/p+1