Chem
J-GLOBAL ID：201407047750241073   Nikkaji number：J3.306.017C

TLSC-702

TLSC-702
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： C18H15NO3S
Molecular formula furigana： C18-H15-N-O3-S
Molecular weight： 325.380
InChI： InChI=1S/C18H15NO3S/c1-22-14-8-6-12(7-9-14)10-13(11-17(20)21)18-19-15-4-2-3-5-16(15)23-18/h2-10H,11H2,1H3,(H,20,21)/b13-10-
InChI key： SONSOTYJHQIJQV-RAXLEYEMSA-N
SMILES： COc1ccc(/C=C(/CC(=O)O)\c2nc3ccccc3s2)cc1
Systematic name  (3)：
  • (Z)-3-(ベンゾチアゾール-2-イル)-4-(4-メトキシフェニル)-3-ブテン酸
  • (3Z)-3-(1,3-ベンゾチアゾール-2-イル)-4-(4-メトキシフェニル)ブタ-3-エン酸
  • (3Z)-3-(1,3-benzothiazol-2-yl)-4-(4-methoxyphenyl)but-3-enoic acid
Other name (2)：
  • (Z)-3-(Benzothiazole-2-yl)-4-(4-methoxyphenyl)-3-butenoic acid
  • TLSC-702
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