Chem
J-GLOBAL ID：200907062415344878   Nikkaji number：J1.188.577B

3-(Acetylamino)-4-imino-3,4,8,9-tetrahydro-5-(4-chlorophenyl)-8,8-dimethyl-5H-[1]benzopyrano[2,3-d]pyrimidine-6(7H)-one

N-[5-(4-クロロフェニル)-4-イミノ-8,8-ジメチル-6-オキソ-3H,4H,5H,6H,7H,8H,9H-クロメノ[2,3-d]ピリミジン-3-イル]アセトアミド
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： C21H21ClN4O3
Molecular formula furigana： C21-H21-CL-N4-O3
Molecular weight： 412.870
InChI： InChI=1S/C21H21ClN4O3/c1-11(27)25-26-10-24-20-18(19(26)23)16(12-4-6-13(22)7-5-12)17-14(28)8-21(2,3)9-15(17)29-20/h4-7,10,16,23H,8-9H2,1-3H3,(H,25,27)
InChI key： PNKXASKTOZLMKN-UHFFFAOYSA-N
SMILES： CC(=O)Nn1cnc2OC3=C(C(c4ccc(Cl)cc4)c2c1=N)C(=O)CC(C)(C)C3
Systematic name  (3)：
  • 3-(アセチルアミノ)-4-イミノ-3,4,8,9-テトラヒドロ-5-(4-クロロフェニル)-8,8-ジメチル-5H-[1]ベンゾピラノ[2,3-d]ピリミジン-6(7H)-オン
  • N-[5-(4-クロロフェニル)-4-イミノ-8,8-ジメチル-6-オキソ-3H,4H,5H,6H,7H,8H,9H-クロメノ[2,3-d]ピリミジン-3-イル]アセトアミド
  • N-[5-(4-chlorophenyl)-4-imino-8,8-dimethyl-6-oxo-3H,4H,5H,6H,7H,8H,9H-chromeno[2,3-d]pyrimidin-3-yl]acetamide
Other name (1)：
  • 3-(Acetylamino)-4-imino-3,4,8,9-tetrahydro-5-(4-chlorophenyl)-8,8-dimethyl-5H-[1]benzopyrano[2,3-d]pyrimidine-6(7H)-one
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