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

Systemtic Name: N'-[[4-oxidanylidene-2-(phenylmethylsulfanyl)pyrido[1,2-a]pyrimidin-5-ium-3-ylidene]methyl]benzohydrazide Openeye Name: N'-[(2-benzylsulfanyl-4-oxo-pyrido[1,2-a]pyrimidin-5-ium-3-ylidene)methyl]benzohydrazide CAS Name: N'-[[4-oxo-2-(phenylmethylthio)-3-pyrido[1,2-a]pyrimidin-5-iumylidene]methyl]benzohydrazide IUPAC Name: N'-[(2-benzylsulfanyl-4-oxopyrido[1,2-a]pyrimidin-5-ium-3-ylidene)methyl]benzohydrazide Traditional Name: N'-[[2-(benzylthio)-4-keto-pyrido[1,2-a]pyrimidin-5-ium-3-ylidene]methyl]benzohydrazide Formula: C23H19N4O2S+ MolecularWeight: 415.48756

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSC2=NC3=CC=CC=[N+]3C(=O)C2=CNNC(=O)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)CSC2=NC3=CC=CC=[N+]3C(=O)C2=CNNC(=O)C4=CC=CC=C4

InChI

InChI=1S/C23H18N4O2S/c28-21(18-11-5-2-6-12-18)26-24-15-19-22(30-16-17-9-3-1-4-10-17)25-20-13-7-8-14-27(20)23(19)29/h1-15H,16H2,(H,26,28)/p+1