Chem
J-GLOBAL ID:200907060775528527
Nikkaji number:J982.720J
7-Methyl-4-phenyl-9-bromo-1,8-(1,8-octanediyl)-4-aza-10-thiatricyclo[5.2.1.02,6 ]dec-8-ene-3,5-dione 10-oxide
7-メチル-4-フェニル-9-ブロモ-1,8-(1,8-オクタンジイル)-4-アザ-10-チアトリシクロ[5.2.1.02,6 ]デカ-8-エン-3,5-ジオン10-オキシド
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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:
C23 H26 BrNO2 [O-][S+]
Molecular formula furigana:
C23-H26-BR-N-O3-S
Molecular weight:
476.430
InChI:
InChI=1S/C23H26BrNO3S/c1-22-16-13-9-4-2-3-5-10-14-23(19(16)24,29(22)28)18-17(22)20(26)25(21(18)27)15-11-7-6-8-12-15/h6-8,11-12,17-18H,2-5,9-10,13-14H2,1H3
InChI key:
DSTMGSMTYHLTTQ-UHFFFAOYSA-N
SMILES:
CC12C3C(C(=O)N(C3=O)c3ccccc3)C3(CCCCCCCCC1=C3Br)[S+]2[O-]
Systematic name (3):
7-メチル-4-フェニル-9-ブロモ-1,8-(1,8-オクタンジイル)-4-アザ-10-チアトリシクロ[5.2.1.02,6 ]デカ-8-エン-3,5-ジオン10-オキシド
17-ブロモ-11-メチル-13,15-ジオキソ-14-フェニル-18-チア-14-アザテトラシクロ[8.6.1.11,11 .012,16 ]オクタデカ-10(17)-エン-18-イウム-18-オラート
17-bromo-11-methyl-13,15-dioxo-14-phenyl-18-thia-14-azatetracyclo[8.6.1.11,11 .012,16 ]octadec-10(17)-en-18-ium-18-olate
Other name (1):
7-Methyl-4-phenyl-9-bromo-1,8-(1,8-octanediyl)-4-aza-10-thiatricyclo[5.2.1.02,6 ]dec-8-ene-3,5-dione 10-oxide
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