N-(3-methylbutyl)-5-oxidanyl-7-oxidanylidene-8H-[1,3]thiazolo[3,2-a]pyrimidin-4-ium-6-carboxamide

Systemtic Name: N-(3-methylbutyl)-5-oxidanyl-7-oxidanylidene-8H-[1,3]thiazolo[3,2-a]pyrimidin-4-ium-6-carboxamide Openeye Name: 5-hydroxy-N-isopentyl-7-oxo-8H-thiazolo[3,2-a]pyrimidin-4-ium-6-carboxamide CAS Name: 5-hydroxy-N-(3-methylbutyl)-7-oxo-8H-thiazolo[3,2-a]pyrimidin-4-ium-6-carboxamide IUPAC Name: 5-hydroxy-N-(3-methylbutyl)-7-oxo-8H-[1,3]thiazolo[3,2-a]pyrimidin-4-ium-6-carboxamide Traditional Name: 5-hydroxy-N-isoamyl-7-keto-8H-thiazolo[3,2-a]pyrimidin-4-ium-6-carboxamide Formula: C12H16N3O3S+ MolecularWeight: 282.33874

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=O)C1=C([N+]2=C(NC1=O)SC=C2)O

Isomeric SMILES

CC(C)CCNC(=O)C1=C([N+]2=C(NC1=O)SC=C2)O

InChI

InChI=1S/C12H15N3O3S/c1-7(2)3-4-13-9(16)8-10(17)14-12-15(11(8)18)5-6-19-12/h5-7H,3-4H2,1-2H3,(H2,13,16,17,18)/p+1