Chem
J-GLOBAL ID:200907062205289076
Nikkaji number:J2.413.368K
(E)-1-Oxo-1-methoxy-2-benzyl-4-[2-(dimethylamino)-4-oxo-4H-pyrido[1,2-a]pyrimidine-3-yl]-3-azonia-3-butene-2-ide
(E)-1-オキソ-1-メトキシ-2-ベンジル-4-[2-(ジメチルアミノ)-4-オキソ-4H-ピリド[1,2-a]ピリミジン-3-イル]-3-アゾニア-3-ブテン-2-イド
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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:
C20 [C-]H22 N3 [N+]O3
Molecular formula furigana:
C21-H22-N4-O3
Molecular weight:
378.432
InChI:
InChI=1S/C21H22N4O3/c1-24(2)19-16(20(26)25-12-8-7-11-18(25)23-19)14-22-17(21(27)28-3)13-15-9-5-4-6-10-15/h4-12,14,22H,13H2,1-3H3/b22-14+
InChI key:
HISZOORFGGZYSE-HYARGMPZSA-N
SMILES:
COC(=O)[C-](Cc1ccccc1)/[NH+]=C/c1c(nc2ccccn2c1=O)N(C)C
Systematic name (3):
(E)-1-オキソ-1-メトキシ-2-ベンジル-4-[2-(ジメチルアミノ)-4-オキソ-4H-ピリド[1,2-a]ピリミジン-3-イル]-3-アゾニア-3-ブテン-2-イド
2-[(E)-{[2-(ジメチルアミノ)-4-オキソ-4H-ピリド[1,2-a]ピリミジン-3-イル]メチリデン}アザニウミル]-1-メトキシ-1-オキソ-3-フェニルプロパン-2-イド
2-[(E)-{[2-(dimethylamino)-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl]methylidene}azaniumyl]-1-methoxy-1-oxo-3-phenylpropan-2-ide
Other name (1):
(E)-1-Oxo-1-methoxy-2-benzyl-4-[2-(dimethylamino)-4-oxo-4H-pyrido[1,2-a]pyrimidine-3-yl]-3-azonia-3-butene-2-ide
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