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Carbamothioic acid, N-(1,3-dihydro-1-oxo-4-isobenzofuranyl)-N-ethyl-, S-(1-phenyl-1H-tetrazol-5-yl) ester
SpectraBase Compound ID 8dBaeU26nm6
InChI InChI=1S/C18H15N5O3S/c1-2-22(15-10-6-9-13-14(15)11-26-16(13)24)18(25)27-17-19-20-21-23(17)12-7-4-3-5-8-12/h3-10H,2,11H2,1H3
InChIKey ZDRLRDQLHYFCLX-UHFFFAOYSA-N
Mol Weight 381.41 g/mol
Molecular Formula C18H15N5O3S
Exact Mass 381.089561 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LMaCGajzc
Name Carbamothioic acid, N-(1,3-dihydro-1-oxo-4-isobenzofuranyl)-N-ethyl-, S-(1-phenyl-1H-tetrazol-5-yl) ester
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Formula C18H15N5O3S
InChI InChI=1S/C18H15N5O3S/c1-2-22(15-10-6-9-13-14(15)11-26-16(13)24)18(25)27-17-19-20-21-23(17)12-7-4-3-5-8-12/h3-10H,2,11H2,1H3
InChIKey ZDRLRDQLHYFCLX-UHFFFAOYSA-N
Molecular Weight 381.410 g/mol
SMILES CCN(C(=O)Sc1nnn[n]1-c1ccccc1)c1cccc2C(=O)OCc12
SPLASH splash10-0fb9-9830000000-22a6ed14cf8c09dde0c3
Source of Spectrum JX-2015-3-1710
Synonyms S-(1-phenyl-1H-tetrazol-5-yl) ethyl(1-oxo-1,3-dihydroisobenzofuran-4-yl)carbamothioate S-(1-phenyl-1H-tetrazol-5-yl) ethyl(1-oxo-1,3-dihydro-2-benzofuran-4-yl)carbamothioate N-ethyl-N-(1-oxo-3H-isobenzofuran-4-yl)carbamothioic acid S-[(1-phenyl-5-tetrazolyl)] ester S-(1-phenyltetrazol-5-yl) N-ethyl-N-(1-oxo-3H-2-benzofuran-4-yl)carbamothioate S-(1-phenyltetrazol-5-yl) N-ethyl-N-(1-oxo-3H-isobenzofuran-4-yl)carbamothioate S-[(1-phenyl-1,2,3,4-tetrazol-5-yl)] N-ethyl-N-(1-oxidanylidene-3H-2-benzofuran-4-yl)carbamothioate
Wiley ID 1725182