Chem
J-GLOBAL ID：201007080981874794   Nikkaji number：J2.814.565I

2-[(Dimethylamino)methyleneamino]-3-(4-nitrophenethyl)-6-(hydroxymethyl)pteridine-4(3H)-one

2-[(ジメチルアミノ)メチレンアミノ]-3-(4-ニトロフェネチル)-6-(ヒドロキシメチル)プテリジン-4(3H)-オン
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： C18H19N6[N+]O3[O-]
Molecular formula furigana： C18-H19-N7-O4
Molecular weight： 397.395
InChI： InChI=1S/C18H19N7O4/c1-23(2)11-20-18-22-16-15(21-13(10-26)9-19-16)17(27)24(18)8-7-12-3-5-14(6-4-12)25(28)29/h3-6,9,11,26H,7-8,10H2,1-2H3
InChI key： QBPIWIAOYHNRCU-UHFFFAOYSA-N
SMILES： CN(C)C=Nc1nc2ncc(CO)nc2c(=O)n1CCc1ccc(cc1)[N+](=O)[O-]
Systematic name  (4)：
  • 6-(ヒドロキシメチル)-2-(ジメチルアミノメチレンアミノ)-3-[2-(4-ニトロフェニル)エチル]プテリジン-4(3H)-オン
  • 2-[(ジメチルアミノ)メチレンアミノ]-3-(4-ニトロフェネチル)-6-(ヒドロキシメチル)プテリジン-4(3H)-オン
  • N'-[6-(ヒドロキシメチル)-3-[2-(4-ニトロフェニル)エチル]-4-オキソ-3,4-ジヒドロプテリジン-2-イル]-N,N-ジメチルメタンイミドアミド
  • N'-[6-(hydroxymethyl)-3-[2-(4-nitrophenyl)ethyl]-4-oxo-3,4-dihydropteridin-2-yl]-N,N-dimethylmethanimidamide
Other name (2)：
  • 6-(Hydroxymethyl)-2-(dimethylaminomethyleneamino)-3-[2-(4-nitrophenyl)ethyl]pteridine-4(3H)-one
  • 2-[(Dimethylamino)methyleneamino]-3-(4-nitrophenethyl)-6-(hydroxymethyl)pteridine-4(3H)-one
Thsaurus map：
Thesaurus Map

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