Chem
J-GLOBAL ID:201207099017635036
Nikkaji number:J3.022.054D
5-(6-Bromobenzothiazole-2-yl)-2′-deoxyuridine
5-(6-ブロモベンゾチアゾール-2-イル)-2′-デオキシウリジン
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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:
C16 H14 BrN3 O5 S
Molecular formula furigana:
C16-H14-BR-N3-O5-S
Molecular weight:
440.270
InChI:
InChI=1S/C16H14BrN3O5S/c17-7-1-2-9-12(3-7)26-15(18-9)8-5-20(16(24)19-14(8)23)13-4-10(22)11(6-21)25-13/h1-3,5,10-11,13,21-22H,4,6H2,(H,19,23,24)/t10-,11+,13+/m0/s1
InChI key:
MGZAOARTRNNJAM-DMDPSCGWSA-N
SMILES:
OC[C@H]1O[C@H](C[C@@H]1O)n1cc(c2nc3ccc(Br)cc3s2)c(=O)[nH]c1=O
Systematic name (3):
5-(6-ブロモベンゾチアゾール-2-イル)-2′-デオキシウリジン
5-(6-ブロモ-1,3-ベンゾチアゾール-2-イル)-1-[(2R,4S,5R)-4-ヒドロキシ-5-(ヒドロキシメチル)オキソラン-2-イル]-1,2,3,4-テトラヒドロピリミジン-2,4-ジオン
5-(6-bromo-1,3-benzothiazol-2-yl)-1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-1,2,3,4-tetrahydropyrimidine-2,4-dione
Other name (1):
5-(6-Bromobenzothiazole-2-yl)-2′-deoxyuridine
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