Chem
J-GLOBAL ID:200907026236389943   Nikkaji number:J1.391.787F

O-Phenyl 4,4-dimethyl-2-(p-nitrophenyl)-1,3-dithioallophanate

O-フェニル4,4-ジメチル-2-(p-ニトロフェニル)-1,3-ジチオアロファナート
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: C16H15N2[N+]O2[O-]S2
Molecular formula furigana: C16-H15-N3-O3-S2
Molecular weight: 361.430
InChI: InChI=1S/C16H15N3O3S2/c1-17(2)15(23)18(12-8-10-13(11-9-12)19(20)21)16(24)22-14-6-4-3-5-7-14/h3-11H,1-2H3
InChI key: ZBYNCHOYGGVQFA-UHFFFAOYSA-N
SMILES: CN(C)C(=S)N(C(=S)Oc1ccccc1)c1ccc(cc1)[N+](=O)[O-]
Systematic name  (4):
  • (4-ニトロフェニル)[(ジメチルアミノ)(チオカルボニル)]チオカルバミド酸O-フェニル
  • N-[ジメチルアミノ(チオカルボニル)]-N-(4-ニトロフェニル)チオカルバミド酸O-フェニル
  • 3,3-ジメチル-1-(4-ニトロフェニル)-1-(フェノキシメタンチオイル)チオ尿素
  • 3,3-dimethyl-1-(4-nitrophenyl)-1-(phenoxymethanethioyl)thiourea
Other name (4):
  • (4-Nitrophenyl)[(dimethylamino)(thiocarbonyl)]thiocarbamic acid O-phenyl ester
  • N-[Dimethylamino(thiocarbonyl)]-N-(4-nitrophenyl)thiocarbamic acid O-phenyl ester
  • O-Phenyl 4,4-dimethyl-2-(p-nitrophenyl)-1,3-dithioallophanate
  • O-フェニル4,4-ジメチル-2-(p-ニトロフェニル)-1,3-ジチオアロファナート
CAS registry number: 22476-89-7
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