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2-Methoxy-N-[4-(4-methyl-5-sulfanyl-4H-1,2,4-triazol-3-yl)phenyl]benzamide
SpectraBase Compound ID BpNe5nTopxW
InChI InChI=1S/C17H16N4O2S/c1-21-15(19-20-17(21)24)11-7-9-12(10-8-11)18-16(22)13-5-3-4-6-14(13)23-2/h3-10H,1-2H3,(H,18,22)(H,20,24)
InChIKey XDZVADYQVYJUQW-UHFFFAOYSA-N
Mol Weight 340.4 g/mol
Molecular Formula C17H16N4O2S
Exact Mass 340.099397 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Bb1w5Q2SaTJ
Name 2-Methoxy-N-[4-(4-methyl-5-sulfanyl-4H-1,2,4-triazol-3-yl)phenyl]benzamide
Alternate Name(s) 2-Methoxy-N-[4-(4-methyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)phenyl]benzamide 2-Methoxy-N-[4-(4-methyl-5-thioxo-1H-1,2,4-triazol-3-yl)phenyl]benzamide Benzamide, N-[4-(5-mercapto-4-methyl-4H-1,2,4-triazol-3-yl)phenyl]-2-methoxy-
CAS Registry Number 299921-29-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H16N4O2S
InChI InChI=1S/C17H16N4O2S/c1-21-15(19-20-17(21)24)11-7-9-12(10-8-11)18-16(22)13-5-3-4-6-14(13)23-2/h3-10H,1-2H3,(H,18,22)(H,20,24)
InChIKey XDZVADYQVYJUQW-UHFFFAOYSA-N
Molecular Weight 340.401 g/mol
SMILES N(C(c1c(OC)cccc1)=O)c1ccc(-c2[n](c(nn2)S)C)cc1
SPLASH splash10-000i-9801000000-328200d1356df7d867c0
Source of Spectrum AD-0-2532-0
Wiley ID 1428742