7-(isoquinolin-2-ium-2-ylmethyl)-[1,3]thiazolo[3,2-a]pyrimidin-5-one

Systemtic Name: 7-(isoquinolin-2-ium-2-ylmethyl)-[1,3]thiazolo[3,2-a]pyrimidin-5-one Openeye Name: 7-(isoquinolin-2-ium-2-ylmethyl)thiazolo[3,2-a]pyrimidin-5-one CAS Name: 7-(2-isoquinolin-2-iumylmethyl)-5-thiazolo[3,2-a]pyrimidinone IUPAC Name: 7-(isoquinolin-2-ium-2-ylmethyl)-[1,3]thiazolo[3,2-a]pyrimidin-5-one Traditional Name: 7-(isoquinolin-2-ium-2-ylmethyl)thiazolo[3,2-a]pyrimidin-5-one Formula: C16H12N3OS+ MolecularWeight: 294.35098

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=[N+](C=CC2=C1)CC3=CC(=O)N4C=CSC4=N3

Isomeric SMILES

C1=CC=C2C=[N+](C=CC2=C1)CC3=CC(=O)N4C=CSC4=N3

InChI

InChI=1S/C16H12N3OS/c20-15-9-14(17-16-19(15)7-8-21-16)11-18-6-5-12-3-1-2-4-13(12)10-18/h1-10H,11H2/q+1