3-[6-[5-cyano-6-(4-methoxyphenyl)-1,2,4-triazin-3-yl]-2-pyridyl]-6-(4-methoxyphenyl)-1,2,4-triazine-5-carbonitrile

SpectraBase Compound ID	3bcLpxA9c3U
InChI	InChI=1S/C27H17N9O2/c1-37-18-10-6-16(7-11-18)24-22(14-28)31-26(35-33-24)20-4-3-5-21(30-20)27-32-23(15-29)25(34-36-27)17-8-12-19(38-2)13-9-17/h3-13H,1-2H3
InChIKey	NXRXVCCUOUBUND-UHFFFAOYSA-N Google Search
Mol Weight	499.49 g/mol
Molecular Formula	C27H17N9O2
Exact Mass	499.150521 g/mol

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SpectraBase Spectrum ID	8J7F9G34nSY
Name	3-[6-[5-cyano-6-(4-methoxyphenyl)-1,2,4-triazin-3-yl]-2-pyridyl]-6-(4-methoxyphenyl)-1,2,4-triazine-5-carbonitrile
Comments	Less than 3 mono-isotopic peaks
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C27H17N9O2
InChI	InChI=1S/C27H17N9O2/c1-37-18-10-6-16(7-11-18)24-22(14-28)31-26(35-33-24)20-4-3-5-21(30-20)27-32-23(15-29)25(34-36-27)17-8-12-19(38-2)13-9-17/h3-13H,1-2H3
InChIKey	NXRXVCCUOUBUND-UHFFFAOYSA-N
Molecular Weight	499.494 g/mol
SMILES	c1(cccc(n1)-c1nnc(c(n1)C#N)-c1ccc(cc1)OC)-c1nnc(c(n1)C#N)-c1ccc(cc1)OC
SPLASH	splash10-0a4i-0900000000-4b777ce43a6c809689bf
Source of Spectrum	F-68-2886-10
Synonyms	3-[6-[5-cyano-6-(4-methoxyphenyl)-1,2,4-triazin-3-yl]pyridin-2-yl]-6-(4-methoxyphenyl)-1,2,4-triazine-5-carbonitrile
Wiley ID	1572204