3-nitro-N'-[[4-oxidanylidene-2-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanyl]pyrido[1,2-a]pyrimidin-5-ium-3-ylidene]methyl]benzohydrazide

Systemtic Name: 3-nitro-N'-[[4-oxidanylidene-2-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanyl]pyrido[1,2-a]pyrimidin-5-ium-3-ylidene]methyl]benzohydrazide Openeye Name: 3-nitro-N'-[[4-oxo-2-(1-phenyltetrazol-5-yl)sulfanyl-pyrido[1,2-a]pyrimidin-5-ium-3-ylidene]methyl]benzohydrazide CAS Name: 3-nitro-N'-[[4-oxo-2-[(1-phenyl-5-tetrazolyl)thio]-3-pyrido[1,2-a]pyrimidin-5-iumylidene]methyl]benzohydrazide IUPAC Name: 3-nitro-N'-[[4-oxo-2-(1-phenyltetrazol-5-yl)sulfanylpyrido[1,2-a]pyrimidin-5-ium-3-ylidene]methyl]benzohydrazide Traditional Name: N'-[[4-keto-2-[(1-phenyltetrazol-5-yl)thio]pyrido[1,2-a]pyrimidin-5-ium-3-ylidene]methyl]-3-nitro-benzohydrazide Formula: C23H16N9O4S+ MolecularWeight: 514.49604

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=NN=N2)SC3=NC4=CC=CC=[N+]4C(=O)C3=CNNC(=O)C5=CC(=CC=C5)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)N2C(=NN=N2)SC3=NC4=CC=CC=[N+]4C(=O)C3=CNNC(=O)C5=CC(=CC=C5)[N+](=O)[O-]

InChI

InChI=1S/C23H15N9O4S/c33-20(15-7-6-10-17(13-15)32(35)36)26-24-14-18-21(25-19-11-4-5-12-30(19)22(18)34)37-23-27-28-29-31(23)16-8-2-1-3-9-16/h1-14H,(H,26,33)/p+1