4-oxidanyl-3-phenyl-1H-pyrimido[2,1-b][1,3]benzothiazol-5-ium-2-one

Systemtic Name: 4-oxidanyl-3-phenyl-1H-pyrimido[2,1-b][1,3]benzothiazol-5-ium-2-one Openeye Name: 4-hydroxy-3-phenyl-1H-pyrimido[2,1-b][1,3]benzothiazol-5-ium-2-one CAS Name: 4-hydroxy-3-phenyl-1H-pyrimido[2,1-b][1,3]benzothiazol-5-ium-2-one IUPAC Name: 4-hydroxy-3-phenyl-1H-pyrimido[2,1-b][1,3]benzothiazol-5-ium-2-one Traditional Name: 4-hydroxy-3-phenyl-1H-pyrimido[2,1-b][1,3]benzothiazol-5-ium-2-one Formula: C16H11N2O2S+ MolecularWeight: 295.33574

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C([N+]3=C(NC2=O)SC4=CC=CC=C43)O

Isomeric SMILES

C1=CC=C(C=C1)C2=C([N+]3=C(NC2=O)SC4=CC=CC=C43)O

InChI

InChI=1S/C16H10N2O2S/c19-14-13(10-6-2-1-3-7-10)15(20)18-11-8-4-5-9-12(11)21-16(18)17-14/h1-9H,(H,19,20)/p+1