Chem
J-GLOBAL ID：200907021563162659   Nikkaji number：J912.649J

7,16-Bis(benzoxazol-2-yl)-1,4-dioxa-10,13-dithia-7,16-diazacyclooctadecane

7,16-ビス(ベンゾオキサゾール-2-イル)-1,4-ジオキサ-10,13-ジチア-7,16-ジアザシクロオクタデカン
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： C26H32N4O4S2
Molecular formula furigana： C26-H32-N4-O4-S2
Molecular weight： 528.690
InChI： InChI=1S/C26H32N4O4S2/c1-3-7-23-21(5-1)27-25(33-23)29-9-13-31-15-16-32-14-10-30(12-18-36-20-19-35-17-11-29)26-28-22-6-2-4-8-24(22)34-26/h1-8H,9-20H2
InChI key： FCTAXYLXCBCRRA-UHFFFAOYSA-N
SMILES： C1COCCN(CCSCCSCCN(CCO1)c1nc2ccccc2o1)c1nc2ccccc2o1
Systematic name  (3)：
  • 7,16-ビス(ベンゾオキサゾール-2-イル)-1,4-ジオキサ-10,13-ジチア-7,16-ジアザシクロオクタデカン
  • 2-[16-(1,3-ベンゾオキサゾール-2-イル)-1,4-ジオキサ-10,13-ジチア-7,16-ジアザシクロオクタデカン-7-イル]-1,3-ベンゾオキサゾール
  • 2-[16-(1,3-benzoxazol-2-yl)-1,4-dioxa-10,13-dithia-7,16-diazacyclooctadecan-7-yl]-1,3-benzoxazole
Other name (1)：
  • 7,16-Bis(benzoxazol-2-yl)-1,4-dioxa-10,13-dithia-7,16-diazacyclooctadecane
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