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1H-Pyrazole-1-acetamide, N-[3-(aminocarbonyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-.alpha.-methyl-4-nitro-
SpectraBase Compound ID 5nTn3eiU8uc
InChI InChI=1S/C15H17N5O4S/c1-8(19-7-9(6-17-19)20(23)24)14(22)18-15-12(13(16)21)10-4-2-3-5-11(10)25-15/h6-8H,2-5H2,1H3,(H2,16,21)(H,18,22)
InChIKey RCQQPRORVSFHFR-UHFFFAOYSA-N
Mol Weight 363.39 g/mol
Molecular Formula C15H17N5O4S
Exact Mass 363.100125 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EbY8s6f1IwH
Name 1H-Pyrazole-1-acetamide, N-[3-(aminocarbonyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-.alpha.-methyl-4-nitro-
Alternate Name(s) 2-[[2-(4-nitro-1-pyrazolyl)-1-oxopropyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide 2-[2-(4-nitropyrazol-1-yl)propanoylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H17N5O4S
InChI InChI=1S/C15H17N5O4S/c1-8(19-7-9(6-17-19)20(23)24)14(22)18-15-12(13(16)21)10-4-2-3-5-11(10)25-15/h6-8H,2-5H2,1H3,(H2,16,21)(H,18,22)
InChIKey RCQQPRORVSFHFR-UHFFFAOYSA-N
Molecular Weight 363.392 g/mol
SMILES NC(c1c(sc2CCCCc12)NC(C([n]1cc(N(=O)=O)cn1)C)=O)=O
SPLASH splash10-0a4l-9861000000-058b95e8ed0318f8a8a1
Source of Spectrum IY-1-4526-0
Wiley ID 1653243