Chem
J-GLOBAL ID：201607003572720009   Nikkaji number：J3.544.140I

Basmisani

バスミスアニル
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： C21H20FN3O3[O-]2[S+2]
Molecular formula furigana： C21-H20-F-N3-O5-S
Molecular weight： 445.470
InChI： InChI=1S/C21H20FN3O5S/c1-14-18(20(24-30-14)15-2-5-17(22)6-3-15)13-29-19-7-4-16(12-23-19)21(26)25-8-10-31(27,28)11-9-25/h2-7,12H,8-11,13H2,1H3
InChI key： VCGRFBXVSFAGGA-UHFFFAOYSA-N
SMILES： Cc1onc(c1COc1ccc(cn1)C(=O)N1CC[S+2]([O-])([O-])CC1)c1ccc(F)cc1
Systematic name  (4)：
  • 4-[[6-[3-(4-フルオロフェニル)-5-メチル-イソオキサゾール-4-イル]メトキシピリジン-3-イル]カルボニル]-テトラヒドロ-2H-1,4-チアジン-1,1-ジオキシド
  • [(テトラヒドロ-2H-1,4-チアジン-1,1-ジオキシド)-4-イル][6-[[3-(4-フルオロフェニル)-5-メチルイソオキサゾール-4-イル]メトキシ]ピリジン-3-イル]メタノン
  • 4-(6-{[3-(4-フルオロフェニル)-5-メチル-1,2-オキサゾール-4-イル]メトキシ}ピリジン-3-カルボニル)チオモルホリン-1,1-ジイウム-1,1-ビス(オラート)
  • 4-(6-{[3-(4-fluorophenyl)-5-methyl-1,2-oxazol-4-yl]methoxy}pyridine-3-carbonyl)thiomorpholine-1,1-diium-1,1-bis(olate)
Other name (4)：
  • 4-[[6-[3-(4-Fluorophenyl)-5-methyl-isoxazol-4-yl]methoxypyridin-3-yl]carbonyl]-tetrahydro-2H-1,4-thiazine-1,1-dioxide
  • バスミスアニル
  • Basmisani
  • [(Tetrahydro-2H-1,4-thiazine-1,1-dioxid)-4-yl][6-[[3-(4-fluorophenyl)-5-methylisoxazol-4-yl]methoxy]pyridin-3-yl]methanone
Thsaurus map：
Thesaurus Map

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