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1-Benzothiophene-2-carboxamide, N-[2-(5-bromo-3-pyridinyl)-1,3-benzoxazol-5-yl]-3-chloro-
SpectraBase Compound ID ValXGCaOCN
InChI InChI=1S/C21H11BrClN3O2S/c22-12-7-11(9-24-10-12)21-26-15-8-13(5-6-16(15)28-21)25-20(27)19-18(23)14-3-1-2-4-17(14)29-19/h1-10H,(H,25,27)
InChIKey IYNRARQBKCGWGX-UHFFFAOYSA-N
Mol Weight 484.76 g/mol
Molecular Formula C21H11BrClN3O2S
Exact Mass 482.944388 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FQ2xQFzP9p1
Name 1-Benzothiophene-2-carboxamide, N-[2-(5-bromo-3-pyridinyl)-1,3-benzoxazol-5-yl]-3-chloro-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H11BrClN3O2S
InChI InChI=1S/C21H11BrClN3O2S/c22-12-7-11(9-24-10-12)21-26-15-8-13(5-6-16(15)28-21)25-20(27)19-18(23)14-3-1-2-4-17(14)29-19/h1-10H,(H,25,27)
InChIKey IYNRARQBKCGWGX-UHFFFAOYSA-N
Molecular Weight 484.755 g/mol
SMILES N(C(c1sc2ccccc2c1Cl)=O)c1cc2nc(-c3cc(Br)cnc3)oc2cc1
SPLASH splash10-0002-2900100000-b33bbbdd1bab40f64cbc
Source of Spectrum IY-1-4664-3
Synonyms N-[2-(5-bromo-3-pyridinyl)-1,3-benzoxazol-5-yl]-3-chloro-1-benzothiophene-2-carboxamide N-[2-(5-bromopyridin-3-yl)-1,3-benzoxazol-5-yl]-3-chloro-1-benzothiophene-2-carboxamide N-[2-(5-bromanylpyridin-3-yl)-1,3-benzoxazol-5-yl]-3-chloranyl-1-benzothiophene-2-carboxamide
Wiley ID 1654626