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2-(N-Methylpiperazino)-4-(2'-benzo[b]thienyl]-6-(2"-furanyl)-pyrimidine
SpectraBase Compound ID 66dv4V4Qz8A
InChI InChI=1S/C21H20N4OS/c1-24-8-10-25(11-9-24)21-22-16(18-6-4-12-26-18)14-17(23-21)20-13-15-5-2-3-7-19(15)27-20/h2-7,12-14H,8-11H2,1H3
InChIKey XBZDHWYSUZYKGR-UHFFFAOYSA-N
Mol Weight 376.48 g/mol
Molecular Formula C21H20N4OS
Exact Mass 376.135782 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID K5f5ZMuLAAu
Name 2-(N-Methylpiperazino)-4-(2'-benzo[b]thienyl]-6-(2"-furanyl)-pyrimidine
Alternate Name(s) 4-(1-benzothiophen-2-yl)-6-(2-furanyl)-2-(4-methyl-1-piperazinyl)pyrimidine 4-(benzothiophen-2-yl)-6-(2-furyl)-2-(4-methylpiperazin-1-yl)pyrimidine 4-(1-benzothiophen-2-yl)-6-(furan-2-yl)-2-(4-methylpiperazin-1-yl)pyrimidine
Comments Less than 3 mono-isotopic peaks
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Formula C21H20N4OS
InChI InChI=1S/C21H20N4OS/c1-24-8-10-25(11-9-24)21-22-16(18-6-4-12-26-18)14-17(23-21)20-13-15-5-2-3-7-19(15)27-20/h2-7,12-14H,8-11H2,1H3
InChIKey XBZDHWYSUZYKGR-UHFFFAOYSA-N
Molecular Weight 376.478 g/mol
SMILES c1(nc(-c2sc3ccccc3c2)cc(n1)-c1occc1)N1CCN(CC1)C
SPLASH splash10-0a4i-0009000000-e0abaf8e3a6434617278
Source of Spectrum D8-328-665-10
Wiley ID 1516004