Chem
J-GLOBAL ID:200907026149137970   Nikkaji number:J690.234K

3,4-Dihydro-3β-hydroxy-2,2-dimethyl-4α-[[(3-pyridinylamino)carbonyl]amino]-2H-1-benzopyran-6-carbonitrile

3-[(3S,4R)-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]-1-(ピリジン-3-イル)尿素
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: C18H18N4O3
Molecular formula furigana: C18-H18-N4-O3
Molecular weight: 338.367
InChI: InChI=1S/C18H18N4O3/c1-18(2)16(23)15(13-8-11(9-19)5-6-14(13)25-18)22-17(24)21-12-4-3-7-20-10-12/h3-8,10,15-16,23H,1-2H3,(H2,21,22,24)/t15-,16+/m1/s1
InChI key: VOPFGEFCSPSJGG-CVEARBPZSA-N
SMILES: CC1(C)Oc2ccc(cc2[C@@H](NC(=O)Nc2cccnc2)[C@@H]1O)C#N
Systematic name  (3):
  • 3,4-ジヒドロ-3β-ヒドロキシ-2,2-ジメチル-4α-[[(3-ピリジニルアミノ)カルボニル]アミノ]-2H-1-ベンゾピラン-6-カルボニトリル
  • 3-[(3S,4R)-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]-1-(ピリジン-3-イル)尿素
  • 3-[(3S,4R)-6-cyano-3-hydroxy-2,2-dimethyl-3,4-dihydro-2H-1-benzopyran-4-yl]-1-(pyridin-3-yl)urea
Other name (1):
  • 3,4-Dihydro-3β-hydroxy-2,2-dimethyl-4α-[[(3-pyridinylamino)carbonyl]amino]-2H-1-benzopyran-6-carbonitrile
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