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N-(6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-[5-(2-methylphenyl)-1,2,3,4-tetrazol-2-yl]ethanamide
SpectraBase Compound ID 6FMoiY0Xvuu
InChI InChI=1S/C23H26N6OS/c1-14-7-5-6-8-16(14)21-26-28-29(27-21)13-20(30)25-22-18(12-24)17-10-9-15(23(2,3)4)11-19(17)31-22/h5-8,15H,9-11,13H2,1-4H3,(H,25,30)
InChIKey DWXPGEUTNAZLMQ-UHFFFAOYSA-N
Mol Weight 434.56 g/mol
Molecular Formula C23H26N6OS
Exact Mass 434.188881 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GxcMJLrcpM2
Name N-(6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-[5-(2-methylphenyl)-1,2,3,4-tetrazol-2-yl]ethanamide
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Formula C23H26N6OS
InChI InChI=1S/C23H26N6OS/c1-14-7-5-6-8-16(14)21-26-28-29(27-21)13-20(30)25-22-18(12-24)17-10-9-15(23(2,3)4)11-19(17)31-22/h5-8,15H,9-11,13H2,1-4H3,(H,25,30)
InChIKey DWXPGEUTNAZLMQ-UHFFFAOYSA-N
Molecular Weight 434.562 g/mol
SMILES N(c1c(c2c(s1)CC(CC2)C(C)(C)C)C#N)C(=O)C[n]1nc(nn1)-c1c(cccc1)C
SPLASH splash10-014m-6912100000-8a714c60bb0c5cbfeab1
Synonyms N-(6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-[5-(2-methylphenyl)-2-tetrazolyl]acetamide N-(6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-[5-(2-methylphenyl)tetrazol-2-yl]acetamide N-(6-tert-butyl-3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)-2-[5-(o-tolyl)tetrazol-2-yl]acetamide
Wiley ID 1512389