Chem
J-GLOBAL ID:200907050346613200   Nikkaji number:J2.639.812F

2-(2-Methyl-4-nitrobenzyl)imidazo[2,1-b]benzothiazole

2-(2-メチル-4-ニトロベンジル)イミダゾ[2,1-b]ベンゾチアゾール
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: C17H13N2[N+]O[O-]S
Molecular formula furigana: C17-H13-N3-O2-S
Molecular weight: 323.370
InChI: InChI=1S/C17H13N3O2S/c1-11-8-14(20(21)22)7-6-12(11)9-13-10-19-15-4-2-3-5-16(15)23-17(19)18-13/h2-8,10H,9H2,1H3
InChI key: DDZYWIRTOQTEHC-UHFFFAOYSA-N
SMILES: Cc1cc(ccc1Cc1cn2c(n1)sc1ccccc21)[N+](=O)[O-]
Systematic name  (3):
  • 2-(2-メチル-4-ニトロベンジル)イミダゾ[2,1-b]ベンゾチアゾール
  • 4-[(2-メチル-4-ニトロフェニル)メチル]-7-チア-2,5-ジアザトリシクロ[6.4.0.02,6]ドデカ-1(12),3,5,8,10-ペンタエン
  • 4-[(2-methyl-4-nitrophenyl)methyl]-7-thia-2,5-diazatricyclo[6.4.0.02,6]dodeca-1(12),3,5,8,10-pentaene
Other name (1):
  • 2-(2-Methyl-4-nitrobenzyl)imidazo[2,1-b]benzothiazole
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