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

Systemtic Name: 5-oxidanylidene-N-[(1-phenylcyclohexyl)methyl]-8H-[1,3]thiazolo[3,2-a]pyrimidin-4-ium-6-carboxamide Openeye Name: 5-oxo-N-[(1-phenylcyclohexyl)methyl]-8H-thiazolo[3,2-a]pyrimidin-4-ium-6-carboxamide CAS Name: 5-oxo-N-[(1-phenylcyclohexyl)methyl]-8H-thiazolo[3,2-a]pyrimidin-4-ium-6-carboxamide IUPAC Name: 5-oxo-N-[(1-phenylcyclohexyl)methyl]-8H-[1,3]thiazolo[3,2-a]pyrimidin-4-ium-6-carboxamide Traditional Name: 5-keto-N-[(1-phenylcyclohexyl)methyl]-8H-thiazolo[3,2-a]pyrimidin-4-ium-6-carboxamide Formula: C20H22N3O2S+ MolecularWeight: 368.47258

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)(CNC(=O)C2=CNC3=[N+](C2=O)C=CS3)C4=CC=CC=C4

Isomeric SMILES

C1CCC(CC1)(CNC(=O)C2=CNC3=[N+](C2=O)C=CS3)C4=CC=CC=C4

InChI

InChI=1S/C20H21N3O2S/c24-17(16-13-21-19-23(18(16)25)11-12-26-19)22-14-20(9-5-2-6-10-20)15-7-3-1-4-8-15/h1,3-4,7-8,11-13H,2,5-6,9-10,14H2,(H,22,24)/p+1