7-[(4-phenethylpiperidin-1-yl)methyl]-8H-[1,3]thiazolo[3,2-a]pyrimidin-4-ium-5-one

Systemtic Name: 7-[(4-phenethylpiperidin-1-yl)methyl]-8H-[1,3]thiazolo[3,2-a]pyrimidin-4-ium-5-one Openeye Name: 7-[(4-phenethyl-1-piperidyl)methyl]-8H-thiazolo[3,2-a]pyrimidin-4-ium-5-one CAS Name: 7-[(4-phenethyl-1-piperidinyl)methyl]-8H-thiazolo[3,2-a]pyrimidin-4-ium-5-one IUPAC Name: 7-[(4-phenethylpiperidin-1-yl)methyl]-8H-[1,3]thiazolo[3,2-a]pyrimidin-4-ium-5-one Traditional Name: 7-[(4-phenethylpiperidino)methyl]-8H-thiazolo[3,2-a]pyrimidin-4-ium-5-one Formula: C20H24N3OS+ MolecularWeight: 354.48906

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CCC2=CC=CC=C2)CC3=CC(=O)[N+]4=C(N3)SC=C4

Isomeric SMILES

C1CN(CCC1CCC2=CC=CC=C2)CC3=CC(=O)[N+]4=C(N3)SC=C4

InChI

InChI=1S/C20H23N3OS/c24-19-14-18(21-20-23(19)12-13-25-20)15-22-10-8-17(9-11-22)7-6-16-4-2-1-3-5-16/h1-5,12-14,17H,6-11,15H2/p+1