Chem
J-GLOBAL ID：200907023416749299   Nikkaji number：J2.105.851C

1,3-Dimethyl-5-[bis(1-methyl-2-oxo-1,2-dihydrocyclohepta[b]pyrrole-3-yl)methylene]barbituric acid

1,3-ジメチル-5-[ビス(1-メチル-2-オキソ-1,2-ジヒドロシクロヘプタ[b]ピロール-3-イル)メチレン]バルビツル酸
Substance type：
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula： C27H22N4O5
Molecular formula furigana： C27-H22-N4-O5
Molecular weight： 482.496
InChI： InChI=1S/C27H22N4O5/c1-28-17-13-9-5-7-11-15(17)19(23(28)32)21(22-25(34)30(3)27(36)31(4)26(22)35)20-16-12-8-6-10-14-18(16)29(2)24(20)33/h5-14H,1-4H3
InChI key： ARUTYSSQBKQGNI-UHFFFAOYSA-N
SMILES： CN1C(=O)N(C)C(=O)C(=C(c2c3cccccc3n(C)c2=O)c2c3cccccc3n(C)c2=O)C1=O
Systematic name  (4)：
  • 1,3-ジメチル-5-[ビス(1-メチル-2-オキソ-1,2-ジヒドロシクロヘプタ[b]ピロール-3-イル)メチレン]バルビツル酸
  • 1,3-ジメチル-5-[ビス(1-メチル-2-オキソ-1,2-ジヒドロシクロヘプタ[b]ピロール-3-イル)メチレン]ヘキサヒドロピリミジン-2,4,6-トリオン
  • 5-[ビス({1-メチル-2-オキソ-1H,2H-シクロヘプタ[b]ピロール-3-イル})メチリデン]-1,3-ジメチル-1,3-ジアジナン-2,4,6-トリオン
  • 5-[bis({1-methyl-2-oxo-1H,2H-cyclohepta[b]pyrrol-3-yl})methylidene]-1,3-dimethyl-1,3-diazinane-2,4,6-trione
Other name (2)：
  • 1,3-Dimethyl-5-[bis(1-methyl-2-oxo-1,2-dihydrocyclohepta[b]pyrrole-3-yl)methylene]barbituric acid
  • 1,3-Dimethyl-5-[bis(1-methyl-2-oxo-1,2-dihydrocyclohepta[b]pyrrole-3-yl)methylene]hexahydropyrimidine-2,4,6-trione
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