7-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-3-phenyl-8H-[1,3]thiazolo[3,2-a]pyrimidin-4-ium-5-one

Systemtic Name: 7-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-3-phenyl-8H-[1,3]thiazolo[3,2-a]pyrimidin-4-ium-5-one Openeye Name: 7-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-3-phenyl-8H-thiazolo[3,2-a]pyrimidin-4-ium-5-one CAS Name: 7-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-3-phenyl-8H-thiazolo[3,2-a]pyrimidin-4-ium-5-one IUPAC Name: 7-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-3-phenyl-8H-[1,3]thiazolo[3,2-a]pyrimidin-4-ium-5-one Traditional Name: 7-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-3-phenyl-8H-thiazolo[3,2-a]pyrimidin-4-ium-5-one Formula: C22H20N3OS+ MolecularWeight: 374.4787

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)CC3=CC(=O)[N+]4=C(N3)SC=C4C5=CC=CC=C5

Isomeric SMILES

C1CN(CC2=CC=CC=C21)CC3=CC(=O)[N+]4=C(N3)SC=C4C5=CC=CC=C5

InChI

InChI=1S/C22H19N3OS/c26-21-12-19(14-24-11-10-16-6-4-5-9-18(16)13-24)23-22-25(21)20(15-27-22)17-7-2-1-3-8-17/h1-9,12,15H,10-11,13-14H2/p+1