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N-(3,4-Dichlorophenyl)-N'-(4-([3-(3-hydroxy-1-piperidinyl)propyl]amino)-6-methyl-2-pyrimidinyl)guanidine
SpectraBase Compound ID 72gG8TROoKM
InChI InChI=1S/C20H27Cl2N7O/c1-13-10-18(24-7-3-9-29-8-2-4-15(30)12-29)27-20(25-13)28-19(23)26-14-5-6-16(21)17(22)11-14/h5-6,10-11,15,30H,2-4,7-9,12H2,1H3,(H4,23,24,25,26,27,28)
InChIKey JXSZNBGKLSEBAS-UHFFFAOYSA-N
Mol Weight 452.39 g/mol
Molecular Formula C20H27Cl2N7O
Exact Mass 451.165414 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AAvD9KMMNLj
Name N-(3,4-Dichlorophenyl)-N'-(4-([3-(3-hydroxy-1-piperidinyl)propyl]amino)-6-methyl-2-pyrimidinyl)guanidine
CAS Registry Number 51386-93-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H27Cl2N7O
InChI InChI=1S/C20H27Cl2N7O/c1-13-10-18(24-7-3-9-29-8-2-4-15(30)12-29)27-20(25-13)28-19(23)26-14-5-6-16(21)17(22)11-14/h5-6,10-11,15,30H,2-4,7-9,12H2,1H3,(H4,23,24,25,26,27,28)
InChIKey JXSZNBGKLSEBAS-UHFFFAOYSA-N
Molecular Weight 452.390 g/mol
SMILES N=C(Nc1cc(Cl)c(cc1)Cl)Nc1nc(cc(n1)C)NCCCN1CC(CCC1)O
SPLASH splash10-01ox-8902000000-69217c2c10121bae62d4
Source of Spectrum NP-15-2994-0
Synonyms 1-[3,4-Dichlorophenyl]-3-[4-[[3-[3-hydroxypiperidino]propyl]amino]-6-methyl-2-pyrimidinyl]guanidine 1-(3,4-dichlorophenyl)-2-[4-[3-(3-hydroxy-1-piperidinyl)propylamino]-6-methyl-2-pyrimidinyl]guanidine 1-(3,4-dichlorophenyl)-2-[4-[3-(3-hydroxypiperidin-1-yl)propylamino]-6-methylpyrimidin-2-yl]guanidine 1-(3,4-dichlorophenyl)-2-[4-[3-(3-hydroxy-1-piperidyl)propylamino]-6-methyl-pyrimidin-2-yl]guanidine 1-(3,4-dichlorophenyl)-2-[4-methyl-6-[3-(3-oxidanylpiperidin-1-yl)propylamino]pyrimidin-2-yl]guanidine
Wiley ID 1112410