Chem
J-GLOBAL ID:200907019336932753
Nikkaji number:J600.231E
1,2,3,4-Tetrahydro-N-(4-chlorophenethyl)-6-hydroxy-7-methoxyisoquinoline-2-carbothioamide
1,2,3,4-テトラヒドロ-N-(4-クロロフェネチル)-6-ヒドロキシ-7-メトキシイソキノリン-2-カルボチオアミド
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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:
C19 H21 ClN2 O2 S
Molecular formula furigana:
C19-H21-CL-N2-O2-S
Molecular weight:
376.900
InChI:
InChI=1S/C19H21ClN2O2S/c1-24-18-11-15-12-22(9-7-14(15)10-17(18)23)19(25)21-8-6-13-2-4-16(20)5-3-13/h2-5,10-11,23H,6-9,12H2,1H3,(H,21,25)
InChI key:
PGQKEGKNLJVXMU-UHFFFAOYSA-N
SMILES:
COc1cc2CN(CCc2cc1O)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-ヒドロキシ-7-メトキシイソキノリン-2-カルボチオアミド
N-[2-(4-クロロフェニル)エチル]-6-ヒドロキシ-7-メトキシ-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-hydroxy-7-methoxy-1,2,3,4-tetrahydroisoquinoline-2-carbothioamide
Other name (1):
1,2,3,4-Tetrahydro-N-(4-chlorophenethyl)-6-hydroxy-7-methoxyisoquinoline-2-carbothioamide
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