2-((1H-Benzo[d]imidazol-2-yl)methylthio)-6-phenyl-4-(methylpiperazin-1-yl)pyrimidine-5-carbonitrile

SpectraBase Compound ID	1v4Bn55Vo67
InChI	InChI=1S/C24H23N7S/c1-30-11-13-31(14-12-30)23-18(15-25)22(17-7-3-2-4-8-17)28-24(29-23)32-16-21-26-19-9-5-6-10-20(19)27-21/h2-10H,11-14,16H2,1H3,(H,26,27)
InChIKey	YWZXIJIZHIQWLW-UHFFFAOYSA-N Google Search
Mol Weight	441.56 g/mol
Molecular Formula	C24H23N7S
Exact Mass	441.173565 g/mol

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SpectraBase Spectrum ID	91XCiZZKZVe
Name	2-((1H-Benzo[d]imidazol-2-yl)methylthio)-6-phenyl-4-(methylpiperazin-1-yl)pyrimidine-5-carbonitrile
Comments	Less than 3 mono-isotopic peaks
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C24H23N7S
InChI	InChI=1S/C24H23N7S/c1-30-11-13-31(14-12-30)23-18(15-25)22(17-7-3-2-4-8-17)28-24(29-23)32-16-21-26-19-9-5-6-10-20(19)27-21/h2-10H,11-14,16H2,1H3,(H,26,27)
InChIKey	YWZXIJIZHIQWLW-UHFFFAOYSA-N
Molecular Weight	441.557 g/mol
SMILES	[nH]1c2ccccc2nc1CSc1nc(c(c(-c2ccccc2)n1)C#N)N1CCN(CC1)C
SPLASH	splash10-03di-0009100000-c4860a2392fc84852b48
Source of Spectrum	F2-45-2342-16
Synonyms	2-(1H-benzimidazol-2-ylmethylthio)-4-(4-methyl-1-piperazinyl)-6-phenyl-5-pyrimidinecarbonitrile 2-(1H-benzimidazol-2-ylmethylsulfanyl)-4-(4-methylpiperazin-1-yl)-6-phenylpyrimidine-5-carbonitrile 2-(1H-benzimidazol-2-ylmethylsulfanyl)-4-(4-methylpiperazin-1-yl)-6-phenyl-pyrimidine-5-carbonitrile
Wiley ID	1713445