8-methoxy-4-oxidanyl-3-(2,4,6-trimethylphenyl)-1H-pyrimido[2,1-b][1,3]benzothiazol-5-ium-2-one

Systemtic Name: 8-methoxy-4-oxidanyl-3-(2,4,6-trimethylphenyl)-1H-pyrimido[2,1-b][1,3]benzothiazol-5-ium-2-one Openeye Name: 4-hydroxy-8-methoxy-3-(2,4,6-trimethylphenyl)-1H-pyrimido[2,1-b][1,3]benzothiazol-5-ium-2-one CAS Name: 4-hydroxy-8-methoxy-3-(2,4,6-trimethylphenyl)-1H-pyrimido[2,1-b][1,3]benzothiazol-5-ium-2-one IUPAC Name: 4-hydroxy-8-methoxy-3-(2,4,6-trimethylphenyl)-1H-pyrimido[2,1-b][1,3]benzothiazol-5-ium-2-one Traditional Name: 4-hydroxy-3-mesityl-8-methoxy-1H-pyrimido[2,1-b][1,3]benzothiazol-5-ium-2-one Formula: C20H19N2O3S+ MolecularWeight: 367.44146

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)C2=C([N+]3=C(NC2=O)SC4=C3C=CC(=C4)OC)O)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)C2=C([N+]3=C(NC2=O)SC4=C3C=CC(=C4)OC)O)C

InChI

InChI=1S/C20H18N2O3S/c1-10-7-11(2)16(12(3)8-10)17-18(23)21-20-22(19(17)24)14-6-5-13(25-4)9-15(14)26-20/h5-9H,1-4H3,(H,23,24)/p+1