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2'-[(cyclopropylmethyl)carbamoyl]-5-methyl-2-phenyl-2H-1,2,3-triazole-4-carboxanilide

View entire compound with spectra: 2 NMR, and 1 FTIR

2'-[(cyclopropylmethyl)carbamoyl]-5-methyl-2-phenyl-2H-1,2,3-triazole-4-carboxanilide
SpectraBase Compound ID 2TsIk0vxS6b
InChI InChI=1S/C21H21N5O2/c1-14-19(25-26(24-14)16-7-3-2-4-8-16)21(28)23-18-10-6-5-9-17(18)20(27)22-13-15-11-12-15/h2-10,15H,11-13H2,1H3,(H,22,27)(H,23,28)
InChIKey VLCSPIPISSRBPG-UHFFFAOYSA-N
Mol Weight 375.43 g/mol
Molecular Formula C21H21N5O2
Exact Mass 375.169525 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CMQKIBTd0hO
Name 2'-[(cyclopropylmethyl)carbamoyl]-5-methyl-2-phenyl-2H-1,2,3-triazole-4-carboxanilide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 375.169524934 u
Formula C21H21N5O2
InChI InChI=1S/C21H21N5O2/c1-14-19(25-26(24-14)16-7-3-2-4-8-16)21(28)23-18-10-6-5-9-17(18)20(27)22-13-15-11-12-15/h2-10,15H,11-13H2,1H3,(H,22,27)(H,23,28)
InChIKey VLCSPIPISSRBPG-UHFFFAOYSA-N
Molecular Weight 375.432 g/mol
SMILES N(C=1C(C(=O)NCC2CC2)=CC=CC1)C(C=1C(=NN(N1)C=1C=CC=CC1)C)=O