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Thieno[3,2-d]isothiazole-5-carboxamide, 3-phenyl-
SpectraBase Compound ID AByuuOZuN7K
InChI InChI=1S/C12H8N2OS2/c13-11(15)9-6-8-10(14-17-12(8)16-9)7-4-2-1-3-5-7/h1-6H,(H2,13,15)
InChIKey OYIPRSLMQZFNBR-UHFFFAOYSA-N
Mol Weight 260.33 g/mol
Molecular Formula C12H8N2OS2
Exact Mass 260.007805 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IKGQ3GT5AcA
Name Thieno[3,2-d]isothiazole-5-carboxamide, 3-phenyl-
CAS Registry Number 126938-78-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H8N2OS2
InChI InChI=1S/C12H8N2OS2/c13-11(15)9-6-8-10(14-17-12(8)16-9)7-4-2-1-3-5-7/h1-6H,(H2,13,15)
InChIKey OYIPRSLMQZFNBR-UHFFFAOYSA-N
Molecular Weight 260.329 g/mol
SMILES NC(c1cc2c(s1)snc2-c1ccccc1)=O
SPLASH splash10-03xu-3290000000-227a1ec06b91212dd04a
Source of Spectrum B-42-1299-3
Synonyms 3-Phenylthieno[3,2-d]isothiazole-5-carboxamide 5-Aminocarbonyl-3-phenylthieno[3,2-d]isothiazole
Wiley ID 1263293