2-(chloromethyl)-1H-pyrimido[2,1-b][1,3]benzothiazol-5-ium-4-one

Systemtic Name: 2-(chloromethyl)-1H-pyrimido[2,1-b][1,3]benzothiazol-5-ium-4-one Openeye Name: 2-(chloromethyl)-1H-pyrimido[2,1-b][1,3]benzothiazol-5-ium-4-one CAS Name: 2-(chloromethyl)-1H-pyrimido[2,1-b][1,3]benzothiazol-5-ium-4-one IUPAC Name: 2-(chloromethyl)-1H-pyrimido[2,1-b][1,3]benzothiazol-5-ium-4-one Traditional Name: 2-(chloromethyl)-1H-pyrimido[2,1-b][1,3]benzothiazol-5-ium-4-one Formula: C11H8ClN2OS+ MolecularWeight: 251.71202

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)[N+]3=C(S2)NC(=CC3=O)CCl

Isomeric SMILES

C1=CC=C2C(=C1)[N+]3=C(S2)NC(=CC3=O)CCl

InChI

InChI=1S/C11H7ClN2OS/c12-6-7-5-10(15)14-8-3-1-2-4-9(8)16-11(14)13-7/h1-5H,6H2/p+1