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

Systemtic Name: 7-(azepan-1-ium-1-ylmethyl)-[1,3]thiazolo[3,2-a]pyrimidin-5-one Openeye Name: 7-(azepan-1-ium-1-ylmethyl)thiazolo[3,2-a]pyrimidin-5-one CAS Name: 7-(1-azepan-1-iumylmethyl)-5-thiazolo[3,2-a]pyrimidinone IUPAC Name: 7-(azepan-1-ium-1-ylmethyl)-[1,3]thiazolo[3,2-a]pyrimidin-5-one Traditional Name: 7-(azepan-1-ium-1-ylmethyl)thiazolo[3,2-a]pyrimidin-5-one Formula: C13H18N3OS+ MolecularWeight: 264.36652

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC[NH+](CC1)CC2=CC(=O)N3C=CSC3=N2

Isomeric SMILES

C1CCC[NH+](CC1)CC2=CC(=O)N3C=CSC3=N2

InChI

InChI=1S/C13H17N3OS/c17-12-9-11(14-13-16(12)7-8-18-13)10-15-5-3-1-2-4-6-15/h7-9H,1-6,10H2/p+1