3-(4-nitrophenyl)-[1,3]thiazolo[3,2-a]pyrimidin-4-ium

Systemtic Name: 3-(4-nitrophenyl)-[1,3]thiazolo[3,2-a]pyrimidin-4-ium Openeye Name: 3-(4-nitrophenyl)thiazolo[3,2-a]pyrimidin-4-ium CAS Name: 3-(4-nitrophenyl)thiazolo[3,2-a]pyrimidin-4-ium IUPAC Name: 3-(4-nitrophenyl)-[1,3]thiazolo[3,2-a]pyrimidin-4-ium Traditional Name: 3-(4-nitrophenyl)thiazolo[3,2-a]pyrimidin-4-ium Formula: C12H8N3O2S+ MolecularWeight: 258.27582

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN=C2[N+](=C1)C(=CS2)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CN=C2[N+](=C1)C(=CS2)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C12H8N3O2S/c16-15(17)10-4-2-9(3-5-10)11-8-18-12-13-6-1-7-14(11)12/h1-8H/q+1