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

Systemtic Name: 3-methyl-5-oxidanylidene-N-[(1R)-1-phenylethyl]-8H-[1,3]thiazolo[3,2-a]pyrimidin-4-ium-6-carboxamide Openeye Name: 3-methyl-5-oxo-N-[(1R)-1-phenylethyl]-8H-thiazolo[3,2-a]pyrimidin-4-ium-6-carboxamide CAS Name: 3-methyl-5-oxo-N-[(1R)-1-phenylethyl]-8H-thiazolo[3,2-a]pyrimidin-4-ium-6-carboxamide IUPAC Name: 3-methyl-5-oxo-N-[(1R)-1-phenylethyl]-8H-[1,3]thiazolo[3,2-a]pyrimidin-4-ium-6-carboxamide Traditional Name: 5-keto-3-methyl-N-[(1R)-1-phenylethyl]-8H-thiazolo[3,2-a]pyrimidin-4-ium-6-carboxamide Formula: C16H16N3O2S+ MolecularWeight: 314.38214

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC2=[N+]1C(=O)C(=CN2)C(=O)NC(C)C3=CC=CC=C3

Isomeric SMILES

CC1=CSC2=[N+]1C(=O)C(=CN2)C(=O)N[C@H](C)C3=CC=CC=C3

InChI

InChI=1S/C16H15N3O2S/c1-10-9-22-16-17-8-13(15(21)19(10)16)14(20)18-11(2)12-6-4-3-5-7-12/h3-9,11H,1-2H3,(H,18,20)/p+1/t11-/m1/s1