Chem
J-GLOBAL ID：200907083213708786
Nikkaji number：J2.354.607H
(3S)-N-tert-Butyl-2-[2-(3-chlorophenyl)-4-quinolinylmethyl]-1,2,3,4-tetrahydroisoquinoline-3α-carboxamide
(3S)-N-tert-ブチル-2-[2-(3-クロロフェニル)-4-キノリニルメチル]-1,2,3,4-テトラヒドロイソキノリン-3α-カルボアミド
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： C30H30ClN3O
Molecular formula furigana： C30-H30-CL-N3-O
Molecular weight： 484.040
InChI：
InChI=1S/C30H30ClN3O/c1-30(2,3)33-29(35)28-17-20-9-4-5-10-22(20)18-34(28)19-23-16-27(21-11-8-12-24(31)15-21)32-26-14-7-6-13-25(23)26/h4-16,28H,17-19H2,1-3H3,(H,33,35)/t28-/m0/s1
InChI key：
DLKZVQPSYASZLF-NDEPHWFRSA-N
SMILES：
CC(C)(C)NC(=O)[C@@H]1Cc2ccccc2CN1Cc1cc(nc2ccccc12)c1cccc(Cl)c1
Systematic name (3)：
- (3S)-N-tert-ブチル-2-[2-(3-クロロフェニル)-4-キノリニルメチル]-1,2,3,4-テトラヒドロイソキノリン-3α-カルボアミド
- (3S)-N-tert-ブチル-2-{[2-(3-クロロフェニル)キノリン-4-イル]メチル}-1,2,3,4-テトラヒドロイソキノリン-3-カルボキサミド
- (3S)-N-tert-butyl-2-{[2-(3-chlorophenyl)quinolin-4-yl]methyl}-1,2,3,4-tetrahydroisoquinoline-3-carboxamide
- (3S)-N-tert-Butyl-2-[2-(3-chlorophenyl)-4-quinolinylmethyl]-1,2,3,4-tetrahydroisoquinoline-3α-carboxamide
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