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3-(Benzoylamino)-5-phenyl-isothiazole-4-carbonitrile
SpectraBase Compound ID AqNLHb3RVSw
InChI InChI=1S/C17H11N3OS/c18-11-14-15(12-7-3-1-4-8-12)22-20-16(14)19-17(21)13-9-5-2-6-10-13/h1-10H,(H,19,20,21)
InChIKey UBYJYBQFWIVXQH-UHFFFAOYSA-N
Mol Weight 305.36 g/mol
Molecular Formula C17H11N3OS
Exact Mass 305.062283 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID F296xbXfjto
Name 3-(Benzoylamino)-5-phenyl-isothiazole-4-carbonitrile
Alternate Name(s) N-(4-cyano-5-phenylisothiazol-3-yl)benzamide N-(4-cyano-5-phenyl-3-isothiazolyl)benzamide N-(4-cyano-5-phenyl-1,2-thiazol-3-yl)benzamide
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Formula C17H11N3OS
InChI InChI=1S/C17H11N3OS/c18-11-14-15(12-7-3-1-4-8-12)22-20-16(14)19-17(21)13-9-5-2-6-10-13/h1-10H,(H,19,20,21)
InChIKey UBYJYBQFWIVXQH-UHFFFAOYSA-N
Molecular Weight 305.355 g/mol
SMILES N(c1c(c(sn1)-c1ccccc1)C#N)C(=O)c1ccccc1
SPLASH splash10-0a4i-5911000000-6d3ddaa8ac9adf2c9d9a
Source of Spectrum F5-4-3690-35
Wiley ID 1733001