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2-([(4,6-Dimethyl-2-pyrimidinyl)sulfanyl]methyl)-5-nitro-1H-benzimidazole
SpectraBase Compound ID JBkZvHFWqU4
InChI InChI=1S/C14H13N5O2S/c1-8-5-9(2)16-14(15-8)22-7-13-17-11-4-3-10(19(20)21)6-12(11)18-13/h3-6H,7H2,1-2H3,(H,17,18)
InChIKey VOLMITBBTHYMNC-UHFFFAOYSA-N
Mol Weight 315.35 g/mol
Molecular Formula C14H13N5O2S
Exact Mass 315.078996 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 32ywQY0Uw4Q
Name 2-([(4,6-Dimethyl-2-pyrimidinyl)sulfanyl]methyl)-5-nitro-1H-benzimidazole
Alternate Name(s) 2-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]-6-nitro-1H-benzimidazole 2-[[(4,6-dimethyl-2-pyrimidinyl)thio]methyl]-6-nitro-1H-benzimidazole 2-[[(4,6-dimethylpyrimidin-2-yl)thio]methyl]-6-nitro-1H-benzimidazole Benzimidazole, 2-(4,6-dimethyl-2-pyrimidylthiomethyl)-5-nitro-
CAS Registry Number 347341-48-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H13N5O2S
InChI InChI=1S/C14H13N5O2S/c1-8-5-9(2)16-14(15-8)22-7-13-17-11-4-3-10(19(20)21)6-12(11)18-13/h3-6H,7H2,1-2H3,(H,17,18)
InChIKey VOLMITBBTHYMNC-UHFFFAOYSA-N
Molecular Weight 315.351 g/mol
SMILES [nH]1c(nc2cc(ccc12)N(=O)=O)CSc1nc(C)cc(n1)C
SPLASH splash10-0159-6963000000-688f013ff1de78eaa479
Source of Spectrum AD-0-2532-0
Wiley ID 1432235