5-Amino-1-[4'-cyano-1'-(p-methoxyphenyl)-2',5'-dihydro-1H-pyrrol-3'-yl]-3-(methylthio)-1H-pyrazole-4-carbonitrile

SpectraBase Compound ID	3h8AA2j5W7N
InChI	InChI=1S/C17H16N6OS/c1-24-13-5-3-12(4-6-13)22-9-11(7-18)15(10-22)23-16(20)14(8-19)17(21-23)25-2/h3-6H,9-10,20H2,1-2H3
InChIKey	SKUYOEGOJCNNNR-UHFFFAOYSA-N Google Search
Mol Weight	352.42 g/mol
Molecular Formula	C17H16N6OS
Exact Mass	352.11063 g/mol

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SpectraBase Spectrum ID	B2Tffh8UrTL
Name	5-Amino-1-[4'-cyano-1'-(p-methoxyphenyl)-2',5'-dihydro-1H-pyrrol-3'-yl]-3-(methylthio)-1H-pyrazole-4-carbonitrile
Comments	Less than 3 mono-isotopic peaks
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C17H16N6OS
InChI	InChI=1S/C17H16N6OS/c1-24-13-5-3-12(4-6-13)22-9-11(7-18)15(10-22)23-16(20)14(8-19)17(21-23)25-2/h3-6H,9-10,20H2,1-2H3
InChIKey	SKUYOEGOJCNNNR-UHFFFAOYSA-N
Molecular Weight	352.416 g/mol
SMILES	Nc1[n](C2=C(CN(C2)c2ccc(cc2)OC)C#N)nc(SC)c1C#N
SPLASH	splash10-001i-0900000000-abafefcda958ac587623
Source of Spectrum	AH-140-134-8
Synonyms	5-amino-1-[4-cyano-1-(4-methoxyphenyl)-2,5-dihydropyrrol-3-yl]-3-(methylthio)-4-pyrazolecarbonitrile 5-amino-1-[4-cyano-1-(4-methoxyphenyl)-2,5-dihydropyrrol-3-yl]-3-methylsulfanylpyrazole-4-carbonitrile 5-amino-1-[4-cyano-1-(4-methoxyphenyl)-2,5-dihydropyrrol-3-yl]-3-methylsulfanyl-pyrazole-4-carbonitrile 5-azanyl-1-[4-cyano-1-(4-methoxyphenyl)-2,5-dihydropyrrol-3-yl]-3-methylsulfanyl-pyrazole-4-carbonitrile
Wiley ID	1696216