N-[(2S)-butan-2-yl]-5-oxidanylidene-8H-[1,3]thiazolo[3,2-a]pyrimidin-4-ium-6-carboxamide

Systemtic Name: N-[(2S)-butan-2-yl]-5-oxidanylidene-8H-[1,3]thiazolo[3,2-a]pyrimidin-4-ium-6-carboxamide Openeye Name: N-[(1S)-1-methylpropyl]-5-oxo-8H-thiazolo[3,2-a]pyrimidin-4-ium-6-carboxamide CAS Name: N-[(2S)-butan-2-yl]-5-oxo-8H-thiazolo[3,2-a]pyrimidin-4-ium-6-carboxamide IUPAC Name: N-[(2S)-butan-2-yl]-5-oxo-8H-[1,3]thiazolo[3,2-a]pyrimidin-4-ium-6-carboxamide Traditional Name: 5-keto-N-[(1S)-1-methylpropyl]-8H-thiazolo[3,2-a]pyrimidin-4-ium-6-carboxamide Formula: C11H14N3O2S+ MolecularWeight: 252.31276

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)C1=CNC2=[N+](C1=O)C=CS2

Isomeric SMILES

CC[C@H](C)NC(=O)C1=CNC2=[N+](C1=O)C=CS2

InChI

InChI=1S/C11H13N3O2S/c1-3-7(2)13-9(15)8-6-12-11-14(10(8)16)4-5-17-11/h4-7H,3H2,1-2H3,(H,13,15)/p+1/t7-/m0/s1