Chem
J-GLOBAL ID:200907010115919720   Nikkaji number:J342.064G

(3S)-3,4-Dihydro-3β-hydroxy-2,2-dimethyl-4-(1H-indol-3-ylcarbonylamino)-2H-1-benzopyran-6-carbonitrile

N-[(3S)-6-シアノ-3-ヒドロキシ-2,2-ジメチル-3,4-ジヒドロ-2H-1-ベンゾピラン-4-イル]-1H-インドール-3-カルボキサミド
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: C21H19N3O3
Molecular formula furigana: C21-H19-N3-O3
Molecular weight: 361.401
InChI: InChI=1S/C21H19N3O3/c1-21(2)19(25)18(14-9-12(10-22)7-8-17(14)27-21)24-20(26)15-11-23-16-6-4-3-5-13(15)16/h3-9,11,18-19,23,25H,1-2H3,(H,24,26)/t18?,19-/m0/s1
InChI key: UDKMBTMJEMCASL-GGYWPGCISA-N
SMILES: CC1(C)Oc2ccc(cc2C(NC(=O)c2c[nH]c3ccccc23)[C@@H]1O)C#N
Systematic name  (3):
  • (3S)-3,4-ジヒドロ-3β-ヒドロキシ-2,2-ジメチル-4-(1H-インドール-3-イルカルボニルアミノ)-2H-1-ベンゾピラン-6-カルボニトリル
  • N-[(3S)-6-シアノ-3-ヒドロキシ-2,2-ジメチル-3,4-ジヒドロ-2H-1-ベンゾピラン-4-イル]-1H-インドール-3-カルボキサミド
  • N-[(3S)-6-cyano-3-hydroxy-2,2-dimethyl-3,4-dihydro-2H-1-benzopyran-4-yl]-1H-indole-3-carboxamide
Other name (1):
  • (3S)-3,4-Dihydro-3β-hydroxy-2,2-dimethyl-4-(1H-indol-3-ylcarbonylamino)-2H-1-benzopyran-6-carbonitrile
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