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

Systemtic Name: 2,3-dimethyl-5-oxidanylidene-N-(pyridin-3-ylmethyl)-8H-[1,3]thiazolo[3,2-a]pyrimidin-4-ium-6-carboxamide Openeye Name: 2,3-dimethyl-5-oxo-N-(3-pyridylmethyl)-8H-thiazolo[3,2-a]pyrimidin-4-ium-6-carboxamide CAS Name: 2,3-dimethyl-5-oxo-N-(3-pyridinylmethyl)-8H-thiazolo[3,2-a]pyrimidin-4-ium-6-carboxamide IUPAC Name: 2,3-dimethyl-5-oxo-N-(pyridin-3-ylmethyl)-8H-[1,3]thiazolo[3,2-a]pyrimidin-4-ium-6-carboxamide Traditional Name: 5-keto-2,3-dimethyl-N-(3-pyridylmethyl)-8H-thiazolo[3,2-a]pyrimidin-4-ium-6-carboxamide Formula: C15H15N4O2S+ MolecularWeight: 315.3702

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=[N+]1C(=O)C(=CN2)C(=O)NCC3=CN=CC=C3)C

Isomeric SMILES

CC1=C(SC2=[N+]1C(=O)C(=CN2)C(=O)NCC3=CN=CC=C3)C

InChI

InChI=1S/C15H14N4O2S/c1-9-10(2)22-15-18-8-12(14(21)19(9)15)13(20)17-7-11-4-3-5-16-6-11/h3-6,8H,7H2,1-2H3,(H,17,20)/p+1