Chem
J-GLOBAL ID：200907079279289302   Nikkaji number：J600.230G

1,2,3,4-Tetrahydro-N-(4-chlorophenethyl)-6,7-dihydroxyisoquinoline-2-carbothioamide

1,2,3,4-テトラヒドロ-N-(4-クロロフェネチル)-6,7-ジヒドロキシイソキノリン-2-カルボチオアミド
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： C18H19ClN2O2S
Molecular formula furigana： C18-H19-CL-N2-O2-S
Molecular weight： 362.870
InChI： InChI=1S/C18H19ClN2O2S/c19-15-3-1-12(2-4-15)5-7-20-18(24)21-8-6-13-9-16(22)17(23)10-14(13)11-21/h1-4,9-10,22-23H,5-8,11H2,(H,20,24)
InChI key： ZYUUARRVHJHBRD-UHFFFAOYSA-N
SMILES： Oc1cc2CCN(Cc2cc1O)C(=S)NCCc1ccc(Cl)cc1
Systematic name  (3)：
  • 1,2,3,4-テトラヒドロ-N-(4-クロロフェネチル)-6,7-ジヒドロキシイソキノリン-2-カルボチオアミド
  • N-[2-(4-クロロフェニル)エチル]-6,7-ジヒドロキシ-1,2,3,4-テトラヒドロイソキノリン-2-カルボチオアミド
  • N-[2-(4-chlorophenyl)ethyl]-6,7-dihydroxy-1,2,3,4-tetrahydroisoquinoline-2-carbothioamide
Other name (1)：
  • 1,2,3,4-Tetrahydro-N-(4-chlorophenethyl)-6,7-dihydroxyisoquinoline-2-carbothioamide
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