Chem
J-GLOBAL ID:200907097358814020
Nikkaji number:J342.061B
(3S)-3,4-Dihydro-3β-hydroxy-2,2-dimethyl-4-(2-pyridinylcarbonylamino)-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]ピリジン-2-カルボキサミド
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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:
C18 H17 N3 O3
Molecular formula furigana:
C18-H17-N3-O3
Molecular weight:
323.352
InChI:
InChI=1S/C18H17N3O3/c1-18(2)16(22)15(21-17(23)13-5-3-4-8-20-13)12-9-11(10-19)6-7-14(12)24-18/h3-9,15-16,22H,1-2H3,(H,21,23)/t15?,16-/m0/s1
InChI key:
UEHYAWRPTHBZPN-LYKKTTPLSA-N
SMILES:
CC1(C)Oc2ccc(cc2C(NC(=O)c2ccccn2)[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-(2-ピリジニ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]ピリジン-2-カルボキサミド
N-[(3S)-6-cyano-3-hydroxy-2,2-dimethyl-3,4-dihydro-2H-1-benzopyran-4-yl]pyridine-2-carboxamide
Other name (1):
(3S)-3,4-Dihydro-3β-hydroxy-2,2-dimethyl-4-(2-pyridinylcarbonylamino)-2H-1-benzopyran-6-carbonitrile
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