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#1;KF31327;THIOQUINAPIPERIFIL;3-ETHYL-1,3-DIHYDRO-8-[[[2-[4-(HYDROXYMETHYL)-1-PIPERIDINYL]-PHENYL]-METHYL]-AMINO]-2H-IMIDAZO-[4,5-G]-QUINAZOLINE-2-THIONE
SpectraBase Compound ID 7aIISAkxzF4
InChI InChI=1S/C24H28N6OS/c1-2-30-22-12-19-18(11-20(22)28-24(30)32)23(27-15-26-19)25-13-17-5-3-4-6-21(17)29-9-7-16(14-31)8-10-29/h3-6,11-12,15-16,31H,2,7-10,13-14H2,1H3,(H,28,32)(H,25,26,27)
InChIKey NMKUPEWPVORTPC-UHFFFAOYSA-N
Mol Weight 448.59 g/mol
Molecular Formula C24H28N6OS
Exact Mass 448.204531 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IY9horF57DK
Name #1;KF31327;THIOQUINAPIPERIFIL;3-ETHYL-1,3-DIHYDRO-8-[[[2-[4-(HYDROXYMETHYL)-1-PIPERIDINYL]-PHENYL]-METHYL]-AMINO]-2H-IMIDAZO-[4,5-G]-QUINAZOLINE-2-THIONE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C24H28N6OS
InChI InChI=1S/C24H28N6OS/c1-2-30-22-12-19-18(11-20(22)28-24(30)32)23(27-15-26-19)25-13-17-5-3-4-6-21(17)29-9-7-16(14-31)8-10-29/h3-6,11-12,15-16,31H,2,7-10,13-14H2,1H3,(H,28,32)(H,25,26,27)
InChIKey NMKUPEWPVORTPC-UHFFFAOYSA-N
Literature Reference Author N.UCHIYAMA,K.SAISHO,R.KIKURA-HANAJIRI,Y.HAISHIMA,Y.GODA
Literature Reference Citation CHEM.PHARM.BULL.,56,1331(2008)
Literature Reference DOI 10.1248/cpb.56.1331
Molecular Weight 448.586 g/mol
Sample ID 2249
Solvent DMSO-D6