N'-[(4-oxidanylidene-2-pyrimidin-2-ylsulfanyl-pyrido[1,2-a]pyrimidin-5-ium-3-ylidene)methyl]benzohydrazide

Systemtic Name: N'-[(4-oxidanylidene-2-pyrimidin-2-ylsulfanyl-pyrido[1,2-a]pyrimidin-5-ium-3-ylidene)methyl]benzohydrazide Openeye Name: N'-[(4-oxo-2-pyrimidin-2-ylsulfanyl-pyrido[1,2-a]pyrimidin-5-ium-3-ylidene)methyl]benzohydrazide CAS Name: N'-[[4-oxo-2-(2-pyrimidinylthio)-3-pyrido[1,2-a]pyrimidin-5-iumylidene]methyl]benzohydrazide IUPAC Name: N'-[(4-oxo-2-pyrimidin-2-ylsulfanylpyrido[1,2-a]pyrimidin-5-ium-3-ylidene)methyl]benzohydrazide Traditional Name: N'-[[4-keto-2-(2-pyrimidylthio)pyrido[1,2-a]pyrimidin-5-ium-3-ylidene]methyl]benzohydrazide Formula: C20H15N6O2S+ MolecularWeight: 403.4371

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)NNC=C2C(=NC3=CC=CC=[N+]3C2=O)SC4=NC=CC=N4

Isomeric SMILES

C1=CC=C(C=C1)C(=O)NNC=C2C(=NC3=CC=CC=[N+]3C2=O)SC4=NC=CC=N4

InChI

InChI=1S/C20H14N6O2S/c27-17(14-7-2-1-3-8-14)25-23-13-15-18(29-20-21-10-6-11-22-20)24-16-9-4-5-12-26(16)19(15)28/h1-13H,(H,25,27)/p+1