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4-(4-benzylpiperazin-1-yl)-5-methyl-2-phenyl-thieno[2,3-d]pyrimidine-6-carbonitrile
SpectraBase Compound ID 9aFrxp9fOFt
InChI InChI=1S/C25H23N5S/c1-18-21(16-26)31-25-22(18)24(27-23(28-25)20-10-6-3-7-11-20)30-14-12-29(13-15-30)17-19-8-4-2-5-9-19/h2-11H,12-15,17H2,1H3
InChIKey KSDUXMOLUFIUIV-UHFFFAOYSA-N
Mol Weight 425.55 g/mol
Molecular Formula C25H23N5S
Exact Mass 425.167417 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KpnlzBGXdSi
Name 4-(4-benzylpiperazin-1-yl)-5-methyl-2-phenyl-thieno[2,3-d]pyrimidine-6-carbonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H23N5S
InChI InChI=1S/C25H23N5S/c1-18-21(16-26)31-25-22(18)24(27-23(28-25)20-10-6-3-7-11-20)30-14-12-29(13-15-30)17-19-8-4-2-5-9-19/h2-11H,12-15,17H2,1H3
InChIKey KSDUXMOLUFIUIV-UHFFFAOYSA-N
Molecular Weight 425.554 g/mol
SMILES C(#N)c1c(c2c(nc(nc2N2CCN(CC2)Cc2ccccc2)-c2ccccc2)s1)C
SPLASH splash10-052f-9710000000-0d2232b513ffeb2cc885
Synonyms 4-(4-benzylpiperazino)-5-methyl-2-phenyl-thieno[2,3-d]pyrimidine-6-carbonitrile 5-Methyl-2-phenyl-4-[4-(phenylmethyl)-1-piperazinyl]-6-thieno[2,3-d]pyrimidinecarbonitrile 5-Methyl-2-phenyl-4-[4-(phenylmethyl)piperazin-1-yl]thieno[2,3-d]pyrimidine-6-carbonitrile
Wiley ID 1442396