4-oxidanylidene-2-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanyl]-1H-pyrido[1,2-a]pyrimidin-5-ium-3-carbaldehyde

Systemtic Name: 4-oxidanylidene-2-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanyl]-1H-pyrido[1,2-a]pyrimidin-5-ium-3-carbaldehyde Openeye Name: 4-oxo-2-(1-phenyltetrazol-5-yl)sulfanyl-1H-pyrido[1,2-a]pyrimidin-5-ium-3-carbaldehyde CAS Name: 4-oxo-2-[(1-phenyl-5-tetrazolyl)thio]-1H-pyrido[1,2-a]pyrimidin-5-ium-3-carboxaldehyde IUPAC Name: 4-oxo-2-(1-phenyltetrazol-5-yl)sulfanyl-1H-pyrido[1,2-a]pyrimidin-5-ium-3-carbaldehyde Traditional Name: 4-keto-2-[(1-phenyltetrazol-5-yl)thio]-1H-pyrido[1,2-a]pyrimidin-5-ium-3-carbaldehyde Formula: C16H11N6O2S+ MolecularWeight: 351.36254

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=NN=N2)SC3=C(C(=O)[N+]4=CC=CC=C4N3)C=O

Isomeric SMILES

C1=CC=C(C=C1)N2C(=NN=N2)SC3=C(C(=O)[N+]4=CC=CC=C4N3)C=O

InChI

InChI=1S/C16H10N6O2S/c23-10-12-14(17-13-8-4-5-9-21(13)15(12)24)25-16-18-19-20-22(16)11-6-2-1-3-7-11/h1-10H/p+1