Chem
J-GLOBAL ID：200907034357498530
Nikkaji number：J1.939.147G
3-Phenyl-5,6,7,8-tetrahydroisoquinoline-4-methanethiol
3-フェニル-5,6,7,8-テトラヒドロイソキノリン-4-メタンチオール
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
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
Molecular formula： C16H17NS
Molecular formula furigana： C16-H17-N-S
Molecular weight： 255.380
InChI：
InChI=1S/C16H17NS/c18-11-15-14-9-5-4-8-13(14)10-17-16(15)12-6-2-1-3-7-12/h1-3,6-7,10,18H,4-5,8-9,11H2
InChI key：
IMYARCDJHPFRFE-UHFFFAOYSA-N
SMILES：
SCc1c2CCCCc2cnc1c1ccccc1
Systematic name (3)：
- 3-フェニル-5,6,7,8-テトラヒドロイソキノリン-4-メタンチオール
- (3-フェニル-5,6,7,8-テトラヒドロイソキノリン-4-イル)メタンチオール
- (3-phenyl-5,6,7,8-tetrahydroisoquinolin-4-yl)methanethiol
- 3-Phenyl-5,6,7,8-tetrahydroisoquinoline-4-methanethiol
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