1,3-diethylpyrimido[2,1-b][1,3]benzothiazol-1-ium-2,4-dione

Systemtic Name: 1,3-diethylpyrimido[2,1-b][1,3]benzothiazol-1-ium-2,4-dione Openeye Name: 1,3-diethylpyrimido[2,1-b][1,3]benzothiazol-1-ium-2,4-dione CAS Name: 1,3-diethylpyrimido[2,1-b][1,3]benzothiazol-1-ium-2,4-dione IUPAC Name: 1,3-diethylpyrimido[2,1-b][1,3]benzothiazol-1-ium-2,4-dione Traditional Name: 1,3-diethylpyrimido[2,1-b][1,3]benzothiazol-1-ium-2,4-quinone Formula: C14H15N2O2S+ MolecularWeight: 275.3461

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1C(=O)N2C3=CC=CC=C3SC2=[N+](C1=O)CC

Isomeric SMILES

CCC1C(=O)N2C3=CC=CC=C3SC2=[N+](C1=O)CC

InChI

InChI=1S/C14H15N2O2S/c1-3-9-12(17)15(4-2)14-16(13(9)18)10-7-5-6-8-11(10)19-14/h5-9H,3-4H2,1-2H3/q+1