[azanyl-[1-(4-nitrophenyl)-2-oxidanylidene-pyrrolidin-3-yl]sulfanyl-methylidene]azanium bromide

Systemtic Name: [azanyl-[1-(4-nitrophenyl)-2-oxidanylidene-pyrrolidin-3-yl]sulfanyl-methylidene]azanium bromide Openeye Name: [amino-[1-(4-nitrophenyl)-2-oxo-pyrrolidin-3-yl]sulfanyl-methylene]ammonium bromide CAS Name: [amino-[[1-(4-nitrophenyl)-2-oxo-3-pyrrolidinyl]thio]methylidene]ammonium bromide IUPAC Name: [amino-[1-(4-nitrophenyl)-2-oxopyrrolidin-3-yl]sulfanylmethylidene]azanium bromide Traditional Name: [amino-[[2-keto-1-(4-nitrophenyl)pyrrolidin-3-yl]thio]methylene]ammonium bromide Formula: C11H13BrN4O3S MolecularWeight: 361.21492

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(=O)C1SC(=[NH2+])N)C2=CC=C(C=C2)[N+](=O)[O-].[Br-]

Isomeric SMILES

C1CN(C(=O)C1SC(=[NH2+])N)C2=CC=C(C=C2)[N+](=O)[O-].[Br-]

InChI

InChI=1S/C11H12N4O3S.BrH/c12-11(13)19-9-5-6-14(10(9)16)7-1-3-8(4-2-7)15(17)18;/h1-4,9H,5-6H2,(H3,12,13);1H