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

Systemtic Name: 3-methyl-N-(2-methylpropyl)-5-oxidanylidene-8H-[1,3]thiazolo[3,2-a]pyrimidin-4-ium-6-carboxamide Openeye Name: N-isobutyl-3-methyl-5-oxo-8H-thiazolo[3,2-a]pyrimidin-4-ium-6-carboxamide CAS Name: 3-methyl-N-(2-methylpropyl)-5-oxo-8H-thiazolo[3,2-a]pyrimidin-4-ium-6-carboxamide IUPAC Name: 3-methyl-N-(2-methylpropyl)-5-oxo-8H-[1,3]thiazolo[3,2-a]pyrimidin-4-ium-6-carboxamide Traditional Name: N-isobutyl-5-keto-3-methyl-8H-thiazolo[3,2-a]pyrimidin-4-ium-6-carboxamide Formula: C12H16N3O2S+ MolecularWeight: 266.33934

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC2=[N+]1C(=O)C(=CN2)C(=O)NCC(C)C

Isomeric SMILES

CC1=CSC2=[N+]1C(=O)C(=CN2)C(=O)NCC(C)C

InChI

InChI=1S/C12H15N3O2S/c1-7(2)4-13-10(16)9-5-14-12-15(11(9)17)8(3)6-18-12/h5-7H,4H2,1-3H3,(H,13,16)/p+1