4-chloro-1,3-dimethyl-N-[4-(2-toluidinosulfonyl)phenyl]-1H-pyrazole-5-carboxamide

SpectraBase Compound ID	DHSwqHEKtfe
InChI	InChI=1S/C19H19ClN4O3S/c1-12-6-4-5-7-16(12)23-28(26,27)15-10-8-14(9-11-15)21-19(25)18-17(20)13(2)22-24(18)3/h4-11,23H,1-3H3,(H,21,25)
InChIKey	YMNKTNJHMGWQSU-UHFFFAOYSA-N Google Search
Mol Weight	418.9 g/mol
Molecular Formula	C19H19ClN4O3S
Exact Mass	418.086639 g/mol

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SpectraBase Spectrum ID	JtArhS4nLwG
Name	4-Chloro-1,3-dimethyl-N-[4-(2-toluidinosulfonyl)phenyl]-1H-pyrazole-5-carboxamide
Comments	Computed using HOSE algorithm
Copyright	Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass	418.086639359 u
Formula	C19H19ClN4O3S
InChI	InChI=1S/C19H19ClN4O3S/c1-12-6-4-5-7-16(12)23-28(26,27)15-10-8-14(9-11-15)21-19(25)18-17(20)13(2)22-24(18)3/h4-11,23H,1-3H3,(H,21,25)
InChIKey	YMNKTNJHMGWQSU-UHFFFAOYSA-N
Molecular Weight	418.899 g/mol
SMILES	N(C1=CC=C(S(NC=2C(C)=CC=CC2)(=O)=O)C=C1)C(C=1N(N=C(C1Cl)C)C)=O