N-(4-Methylphenyl)-2-{[(4-phenyl-5-pyridin-4-yl-4H-1,2,4-triazol-3-yl)thio]acetyl} hydrazinecarbothioamide

SpectraBase Compound ID	KiHRa4Ffk5Z
InChI	InChI=1S/C23H21N7OS2/c1-16-7-9-18(10-8-16)25-22(32)28-26-20(31)15-33-23-29-27-21(17-11-13-24-14-12-17)30(23)19-5-3-2-4-6-19/h2-14H,15H2,1H3,(H,26,31)(H2,25,28,32)
InChIKey	BWIWFZHJEXLDSF-UHFFFAOYSA-N Google Search
Mol Weight	475.59 g/mol
Molecular Formula	C23H21N7OS2
Exact Mass	475.124901 g/mol

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SpectraBase Spectrum ID	2TZmVbIf3Tb
Name	N-(4-Methylphenyl)-2-{[(4-phenyl-5-pyridin-4-yl-4H-1,2,4-triazol-3-yl)thio]acetyl} hydrazinecarbothioamide
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C23H21N7OS2
InChI	InChI=1S/C23H21N7OS2/c1-16-7-9-18(10-8-16)25-22(32)28-26-20(31)15-33-23-29-27-21(17-11-13-24-14-12-17)30(23)19-5-3-2-4-6-19/h2-14H,15H2,1H3,(H,26,31)(H2,25,28,32)
InChIKey	BWIWFZHJEXLDSF-UHFFFAOYSA-N
Molecular Weight	475.589 g/mol
SMILES	N(NC(=O)CSc1nnc([n]1-c1ccccc1)-c1ccncc1)C(=S)Nc1ccc(cc1)C
SPLASH	splash10-000i-0419100000-bed93058baf51eabf5b4
Source of Spectrum	F2-44-1754-8
Synonyms	1-(4-Methylphenyl)-3-[[1-oxo-2-[(4-phenyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)thio]ethyl]amino]thiourea 1-(4-Methylphenyl)-3-[[2-[(4-phenyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]thiourea 1-[[2-[[4-phenyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]-3-(p-tolyl)thiourea 1-(4-Methylphenyl)-3-[2-[(4-phenyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]ethanoylamino]thiourea
Wiley ID	1716353