Chem
J-GLOBAL ID：200907000395211293
Nikkaji number：J2.018.120F
2-[1-[[(2S,3R)-2-(2-Phenyl-4-thiazolylcarbonylamino)-3-hydroxybutyryl]amino]-1-propenyl]thiazole-4-carboxylic acid
2-[1-[[(2S,3R)-2-(2-フェニル-4-チアゾリルカルボニルアミノ)-3-ヒドロキシブチリル]アミノ]-1-プロペニル]チアゾール-4-カルボン酸
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
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
Molecular formula： C21H20N4O5S2
Molecular formula furigana： C21-H20-N4-O5-S2
Molecular weight： 472.530
InChI：
InChI=1S/C21H20N4O5S2/c1-3-13(20-24-15(10-32-20)21(29)30)22-18(28)16(11(2)26)25-17(27)14-9-31-19(23-14)12-7-5-4-6-8-12/h3-11,16,26H,1-2H3,(H,22,28)(H,25,27)(H,29,30)/t11-,16+/m1/s1
InChI key：
JPDANTFOVGETSC-BZNIZROVSA-N
SMILES：
CC=C(NC(=O)[C@@H](NC(=O)c1csc(n1)c1ccccc1)[C@@H](C)O)c1nc(cs1)C(=O)O
Systematic name (3)：
- 2-[1-[[(2S,3R)-2-(2-フェニル-4-チアゾリルカルボニルアミノ)-3-ヒドロキシブチリル]アミノ]-1-プロペニル]チアゾール-4-カルボン酸
- 2-{1-[(2S,3R)-3-ヒドロキシ-2-[(2-フェニル-1,3-チアゾール-4-イル)ホルムアミド]ブタンアミド]プロパ-1-エン-1-イル}-1,3-チアゾール-4-カルボン酸
- 2-{1-[(2S,3R)-3-hydroxy-2-[(2-phenyl-1,3-thiazol-4-yl)formamido]butanamido]prop-1-en-1-yl}-1,3-thiazole-4-carboxylic acid
- 2-[1-[[(2S,3R)-2-(2-Phenyl-4-thiazolylcarbonylamino)-3-hydroxybutyryl]amino]-1-propenyl]thiazole-4-carboxylic acid
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