(3-nitrophenyl)-[3-[(5-phenyl-1,2,3,4-tetrazol-2-yl)methyl]-5-sulfanylidene-1H-1,2,4-triazol-4-yl]methanone

SpectraBase Compound ID	K5nJxUaJ822
InChI	InChI=1S/C17H12N8O3S/c26-16(12-7-4-8-13(9-12)25(27)28)24-14(18-20-17(24)29)10-23-21-15(19-22-23)11-5-2-1-3-6-11/h1-9H,10H2,(H,20,29)
InChIKey	UTKMCQUHQJUEJZ-UHFFFAOYSA-N Google Search
Mol Weight	408.4 g/mol
Molecular Formula	C17H12N8O3S
Exact Mass	408.075307 g/mol

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SpectraBase Spectrum ID	ItMwxtv6YxD
Name	(3-nitrophenyl)-[3-[(5-phenyl-1,2,3,4-tetrazol-2-yl)methyl]-5-sulfanylidene-1H-1,2,4-triazol-4-yl]methanone
Copyright	Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C17H12N8O3S
InChI	InChI=1S/C17H12N8O3S/c26-16(12-7-4-8-13(9-12)25(27)28)24-14(18-20-17(24)29)10-23-21-15(19-22-23)11-5-2-1-3-6-11/h1-9H,10H2,(H,20,29)
InChIKey	UTKMCQUHQJUEJZ-UHFFFAOYSA-N
Molecular Weight	408.396 g/mol
SMILES	N1N=C(N(C1=S)C(c1cc(N(=O)=O)ccc1)=O)C[n]1nc(-c2ccccc2)nn1
SPLASH	splash10-0f92-2921000000-d47c4935051b8a470f2a
Source of Spectrum	OP-24-494-2
Synonyms	(3-nitrophenyl)-[3-[(5-phenyl-2-tetrazolyl)methyl]-5-sulfanylidene-1H-1,2,4-triazol-4-yl]methanone (3-nitrophenyl)-[3-[(5-phenyltetrazol-2-yl)methyl]-5-sulfanylidene-1H-1,2,4-triazol-4-yl]methanone (3-nitrophenyl)-[3-[(5-phenyltetrazol-2-yl)methyl]-5-thioxo-1H-1,2,4-triazol-4-yl]methanone
Wiley ID	850396