Chem
J-GLOBAL ID:200907046090355287
Nikkaji number:J259.887F
(-)-McN-5652
(-)-McN-5652
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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 NS
Molecular formula furigana:
C19-H21-N-S
Molecular weight:
295.440
InChI:
InChI=1S/C19H21NS/c1-21-15-10-8-14(9-11-15)18-13-20-12-4-7-19(20)17-6-3-2-5-16(17)18/h2-3,5-6,8-11,18-19H,4,7,12-13H2,1H3/t18-,19+/m1/s1
InChI key:
YVKDUIAAPBKHMJ-MOPGFXCFSA-N
SMILES:
CSc1ccc(cc1)[C@H]1CN2CCC[C@H]2c2ccccc12
Systematic name (5):
(6R)-1,2,3,5,6,10bβ-ヘキサヒドロ-6α-[4-(メチルチオ)フェニル]ピロロ[2,1-a]イソキノリン
[6R,(-)]-1,2,3,5,6,10bβ-ヘキサヒドロ-6α-[4-(メチルチオ)フェニル]ピロロ[2,1-a]イソキノリン
1,2,3,5,6,10bβ-ヘキサヒドロ-6α-[4-(メチルチオ)フェニル]ピロロ[2,1-a]イソキノリン
(6R,10bS)-6-[4-(メチルスルファニル)フェニル]-1H,2H,3H,5H,6H,10bH-ピロロ[2,1-a]イソキノリン
(6R,10bS)-6-[4-(methylsulfanyl)phenyl]-1H,2H,3H,5H,6H,10bH-pyrrolo[2,1-a]isoquinoline
Other name (4):
(-)-McN-5652-Z
1,2,3,5,6,10bβ-Hexahydro-6α-[4-(methylthio)phenyl]pyrrolo[2,1-a]isoquinoline
(-)-McN-5652Z
(-)-McN-5652
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