Chem
J-GLOBAL ID:200907048507945050   Nikkaji number:J304.735K

2-[[[Phenylamino]acetyl]amino]-5-[(ethoxycarbonylmethyl)thio]-1H-pyrrole-3,4-dicarboxamide

2-[[[フェニルアミノ]アセチル]アミノ]-5-[(エトキシカルボニルメチル)チオ]-1H-ピロール-3,4-ジカルボアミド
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: C18H21N5O5S
Molecular formula furigana: C18-H21-N5-O5-S
Molecular weight: 419.460
InChI: InChI=1S/C18H21N5O5S/c1-2-28-12(25)9-29-18-14(16(20)27)13(15(19)26)17(23-18)22-11(24)8-21-10-6-4-3-5-7-10/h3-7,21,23H,2,8-9H2,1H3,(H2,19,26)(H2,20,27)(H,22,24)
InChI key: SBNGTSBEJOJWPV-UHFFFAOYSA-N
SMILES: CCOC(=O)CSc1[nH]c(NC(=O)CNc2ccccc2)c(C(=O)N)c1C(=O)N
Systematic name  (3):
  • 2-[[[フェニルアミノ]アセチル]アミノ]-5-[(エトキシカルボニルメチル)チオ]-1H-ピロール-3,4-ジカルボアミド
  • エチル 2-({3,4-ジカルバモイル-5-[2-(フェニルアミノ)アセトアミド]-1H-ピロール-2-イル}スルファニル)アセタート
  • ethyl 2-({3,4-dicarbamoyl-5-[2-(phenylamino)acetamido]-1H-pyrrol-2-yl}sulfanyl)acetate
Other name (1):
  • 2-[[[Phenylamino]acetyl]amino]-5-[(ethoxycarbonylmethyl)thio]-1H-pyrrole-3,4-dicarboxamide
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