Chem
J-GLOBAL ID:200907013197952886
Nikkaji number:J949.868K
OT-1222
2-(ベンジルアミノ)-4-(フェネチルチオ)-5-スルファモイル安息香酸
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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:
C22 H22 N2 O4 S2
Molecular formula furigana:
C22-H22-N2-O4-S2
Molecular weight:
442.550
InChI:
InChI=1S/C22H22N2O4S2/c23-30(27,28)21-13-18(22(25)26)19(24-15-17-9-5-2-6-10-17)14-20(21)29-12-11-16-7-3-1-4-8-16/h1-10,13-14,24H,11-12,15H2,(H,25,26)(H2,23,27,28)
InChI key:
QPODMDUHMCQOND-UHFFFAOYSA-N
SMILES:
NS(=O)(=O)c1cc(C(=O)O)c(NCc2ccccc2)cc1SCCc1ccccc1
Systematic name (3):
2-(ベンジルアミノ)-4-(フェネチルチオ)-5-スルファモイル安息香酸
2-(ベンジルアミノ)-4-[(2-フェニルエチル)スルファニル]-5-スルファモイル安息香酸
2-(benzylamino)-4-[(2-phenylethyl)sulfanyl]-5-sulfamoylbenzoic acid
Other name (2):
OT-1222
2-(Benzylamino)-4-(phenethylthio)-5-sulfamoylbenzoic acid
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