5-((2-[(Diethylamino)methyl]-1,3-benzodioxol-5-yl)methyl)-2,4-pyrimidinediamine

SpectraBase Compound ID	KSsNePBbWIc
InChI	InChI=1S/C17H23N5O2/c1-3-22(4-2)10-15-23-13-6-5-11(8-14(13)24-15)7-12-9-20-17(19)21-16(12)18/h5-6,8-9,15H,3-4,7,10H2,1-2H3,(H4,18,19,20,21)
InChIKey	FOLMLIUUSUSQLL-UHFFFAOYSA-N Google Search
Mol Weight	329.4 g/mol
Molecular Formula	C17H23N5O2
Exact Mass	329.185175 g/mol

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SpectraBase Spectrum ID	InKkIndQUdF
Name	5-((2-[(Diethylamino)methyl]-1,3-benzodioxol-5-yl)methyl)-2,4-pyrimidinediamine
Alternate Name(s)	1,3(2H)-Benzodioxole, 2-[(diethylamino)methyl]-5-[(2,4-diamino-5-pyrimidinyl)methyl]- 5-[[2-(diethylaminomethyl)-1,3-benzodioxol-5-yl]methyl]pyrimidine-2,4-diamine
CAS Registry Number	71525-14-9
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C17H23N5O2
InChI	InChI=1S/C17H23N5O2/c1-3-22(4-2)10-15-23-13-6-5-11(8-14(13)24-15)7-12-9-20-17(19)21-16(12)18/h5-6,8-9,15H,3-4,7,10H2,1-2H3,(H4,18,19,20,21)
InChIKey	FOLMLIUUSUSQLL-UHFFFAOYSA-N
Molecular Weight	329.404 g/mol
SMILES	Nc1ncc(c(n1)N)Cc1ccc2c(c1)OC(O2)CN(CC)CC
SPLASH	splash10-000i-9000000000-ed24a9bd4b26fc9ff101
Source of Spectrum	NP-11-6919-0
Wiley ID	1109796