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N-[3-(4-Methoxyphenyl)-4-(phenylmethyl)-1,2,4-thiadiazol-5(4H)-ylidene]-4-methylbenzenesulfonamide
SpectraBase Compound ID LQquVGwTfQ0
InChI InChI=1S/C23H21N3O3S2/c1-17-8-14-21(15-9-17)31(27,28)25-23-26(16-18-6-4-3-5-7-18)22(24-30-23)19-10-12-20(29-2)13-11-19/h3-15H,16H2,1-2H3/b25-23-
InChIKey FOBNLXSLSSLOMD-BZZOAKBMSA-N
Mol Weight 451.56 g/mol
Molecular Formula C23H21N3O3S2
Exact Mass 451.102434 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID L2Vo404WywV
Name N-[3-(4-Methoxyphenyl)-4-(phenylmethyl)-1,2,4-thiadiazol-5(4H)-ylidene]-4-methylbenzenesulfonamide
CAS Registry Number 59938-51-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H21N3O3S2
InChI InChI=1S/C23H21N3O3S2/c1-17-8-14-21(15-9-17)31(27,28)25-23-26(16-18-6-4-3-5-7-18)22(24-30-23)19-10-12-20(29-2)13-11-19/h3-15H,16H2,1-2H3/b25-23-
InChIKey FOBNLXSLSSLOMD-BZZOAKBMSA-N
Molecular Weight 451.559 g/mol
SMILES c1(S(\N=C\2N(C(=NS2)c2ccc(cc2)OC)Cc2ccccc2)(=O)=O)ccc(cc1)C
SPLASH splash10-0006-9050400000-7a67d1c911eef94e6077
Source of Spectrum J-41-3406-0
Synonyms N-((5Z)-4-benzyl-3-(4-methoxyphenyl)-1,2,4-thiadiazol-5(4H)-ylidene)-4-methylbenzenesulfonamide
Wiley ID 1387951