(2-anilino-1-cyclohexenyl)-[5-chloro-1-(phenylmethyl)-4-triazolyl]methanone

SpectraBase Compound ID	9NLXiw3XS7O
InChI	InChI=1S/C22H21ClN4O/c23-22-20(25-26-27(22)15-16-9-3-1-4-10-16)21(28)18-13-7-8-14-19(18)24-17-11-5-2-6-12-17/h1-6,9-12,24H,7-8,13-15H2
InChIKey	KMFLWQPIWDOAFK-UHFFFAOYSA-N Google Search
Mol Weight	392.89 g/mol
Molecular Formula	C22H21ClN4O
Exact Mass	392.140389 g/mol

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SpectraBase Spectrum ID	BhfhblX4iOK
Name	(2-anilino-1-cyclohexenyl)-[5-chloro-1-(phenylmethyl)-4-triazolyl]methanone
Alternate Name(s)	(2-anilinocyclohexen-1-yl)-(1-benzyl-5-chloro-triazol-4-yl)methanone [5-chloranyl-1-(phenylmethyl)-1,2,3-triazol-4-yl]-(2-phenylazanylcyclohexen-1-yl)methanone
CAS Registry Number	129609-23-0
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C22H21ClN4O
InChI	InChI=1S/C22H21ClN4O/c23-22-20(25-26-27(22)15-16-9-3-1-4-10-16)21(28)18-13-7-8-14-19(18)24-17-11-5-2-6-12-17/h1-6,9-12,24H,7-8,13-15H2
InChIKey	KMFLWQPIWDOAFK-UHFFFAOYSA-N
Molecular Weight	392.890 g/mol
SMILES	N(C1=C(C(c2c([n](Cc3ccccc3)nn2)Cl)=O)CCCC1)c1ccccc1
SPLASH	splash10-0006-9004000000-f0616265fcfae362df99
Source of Spectrum	Y-27-1138-7
Wiley ID	1365817