5-oxidanylidene-8-(3-oxidanylpropyl)-6-phenyl-[1,3]thiazolo[3,2-a]pyrimidin-8-ium-7-olate

Systemtic Name: 5-oxidanylidene-8-(3-oxidanylpropyl)-6-phenyl-[1,3]thiazolo[3,2-a]pyrimidin-8-ium-7-olate Openeye Name: 8-(3-hydroxypropyl)-5-oxo-6-phenyl-thiazolo[3,2-a]pyrimidin-8-ium-7-olate CAS Name: 8-(3-hydroxypropyl)-5-oxo-6-phenyl-7-thiazolo[3,2-a]pyrimidin-8-iumolate IUPAC Name: 8-(3-hydroxypropyl)-5-oxo-6-phenyl-[1,3]thiazolo[3,2-a]pyrimidin-8-ium-7-olate Traditional Name: 8-(3-hydroxypropyl)-5-keto-6-phenyl-thiazolo[3,2-a]pyrimidin-8-ium-7-olate Formula: C15H14N2O3S MolecularWeight: 302.34826

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C([N+](=C3N(C2=O)C=CS3)CCCO)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C2=C([N+](=C3N(C2=O)C=CS3)CCCO)[O-]

InChI

InChI=1S/C15H14N2O3S/c18-9-4-7-16-13(19)12(11-5-2-1-3-6-11)14(20)17-8-10-21-15(16)17/h1-3,5-6,8,10,18H,4,7,9H2