Chem
J-GLOBAL ID:200907068572855604
Nikkaji number:J776.807I
9-(Ethoxycarbonyl)-2-thia-1,3,6,8-tetraaza-2H-cyclopenta[a]naphthalene 6-oxide
9-(エトキシカルボニル)-[1,2,5]チアジアゾロ[3,4-f]キナゾリン-6-イウム-6-オラート
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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:
C11 H8 N3 [N+]O2 [O-]S
Molecular formula furigana:
C11-H8-N4-O3-S
Molecular weight:
276.270
InChI:
InChI=1S/C11H8N4O3S/c1-2-18-11(16)10-8-7(15(17)5-12-10)4-3-6-9(8)14-19-13-6/h3-5H,2H2,1H3
InChI key:
DUKBXXVRHHBSIQ-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1nc[n+]([O-])c2ccc3nsnc3c12
Systematic name (3):
9-(エトキシカルボニル)-2-チア-1,3,6,8-テトラアザ-2H-シクロペンタ[a]ナフタレン6-オキシド
9-(エトキシカルボニル)-[1,2,5]チアジアゾロ[3,4-f]キナゾリン-6-イウム-6-オラート
9-(ethoxycarbonyl)-[1,2,5]thiadiazolo[3,4-f]quinazolin-6-ium-6-olate
Other name (1):
9-(Ethoxycarbonyl)-2-thia-1,3,6,8-tetraaza-2H-cyclopenta[a]naphthalene 6-oxide
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