9-methyl-3-[(2-naphthalen-2-ylhydrazinyl)methylidene]-2-(phenylmethylsulfanyl)pyrido[1,2-a]pyrimidin-5-ium-4-one

Systemtic Name: 9-methyl-3-[(2-naphthalen-2-ylhydrazinyl)methylidene]-2-(phenylmethylsulfanyl)pyrido[1,2-a]pyrimidin-5-ium-4-one Openeye Name: 2-benzylsulfanyl-9-methyl-3-[[2-(2-naphthyl)hydrazino]methylene]pyrido[1,2-a]pyrimidin-5-ium-4-one CAS Name: 9-methyl-3-[(2-naphthalenylhydrazo)methylidene]-2-(phenylmethylthio)-4-pyrido[1,2-a]pyrimidin-5-iumone IUPAC Name: 2-benzylsulfanyl-9-methyl-3-[(2-naphthalen-2-ylhydrazinyl)methylidene]pyrido[1,2-a]pyrimidin-5-ium-4-one Traditional Name: 2-(benzylthio)-9-methyl-3-[[N'-(2-naphthyl)hydrazino]methylene]pyrido[1,2-a]pyrimidin-5-ium-4-one Formula: C27H23N4OS+ MolecularWeight: 451.56272

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2N=C(C(=CNNC3=CC4=CC=CC=C4C=C3)C(=O)[N+]2=CC=C1)SCC5=CC=CC=C5

Isomeric SMILES

CC1=C2N=C(C(=CNNC3=CC4=CC=CC=C4C=C3)C(=O)[N+]2=CC=C1)SCC5=CC=CC=C5

InChI

InChI=1S/C27H22N4OS/c1-19-8-7-15-31-25(19)29-26(33-18-20-9-3-2-4-10-20)24(27(31)32)17-28-30-23-14-13-21-11-5-6-12-22(21)16-23/h2-17,30H,18H2,1H3/p+1