3-([4-(4-Amino-2-imino-6,6-dimethyl-3,6-dihydro-1,3,5-triazin-1(2H)-yl)-2-chlorophenoxy]methyl)-N,N-dimethylbenzamide

SpectraBase Compound ID	4ldEq9VJG6W
InChI	InChI=1S/C21H25ClN6O2/c1-21(2)26-19(23)25-20(24)28(21)15-8-9-17(16(22)11-15)30-12-13-6-5-7-14(10-13)18(29)27(3)4/h5-11H,12H2,1-4H3,(H4,23,24,25,26)
InChIKey	WJHBDAIAIDOONY-UHFFFAOYSA-N Google Search
Mol Weight	428.92 g/mol
Molecular Formula	C21H25ClN6O2
Exact Mass	428.172752 g/mol

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SpectraBase Spectrum ID	AtDtXCu40ZH
Name	3-([4-(4-Amino-2-imino-6,6-dimethyl-3,6-dihydro-1,3,5-triazin-1(2H)-yl)-2-chlorophenoxy]methyl)-N,N-dimethylbenzamide
CAS Registry Number	41191-04-2
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C21H25ClN6O2
InChI	InChI=1S/C21H25ClN6O2/c1-21(2)26-19(23)25-20(24)28(21)15-8-9-17(16(22)11-15)30-12-13-6-5-7-14(10-13)18(29)27(3)4/h5-11H,12H2,1-4H3,(H4,23,24,25,26)
InChIKey	WJHBDAIAIDOONY-UHFFFAOYSA-N
Molecular Weight	428.924 g/mol
SMILES	N1C(=NC(N(C1=N)c1ccc(c(c1)Cl)OCc1cc(ccc1)C(N(C)C)=O)(C)C)N
SPLASH	splash10-0006-9700000000-6a4e03ad8196f74a432f
Source of Spectrum	NP-14-9932-0
Synonyms	.alpha.-(2-Chloro-4-(4,6-diamino-2,2-dimethyl-s-triazin-1(2H)-yl)-phenoxy)-N,N-dimethyl-m-toluamide 3-((2-Chloro-4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1(2H)-yl)phenoxy)methyl)-N,N-dimethylbenzamide Baker'S antifolante m-Toluamide, .alpha.-(2-chloro-4-(4,6-diamino-2,2-dimethyl-s-triazine-1(2H)-yl)phenoxy)-N,N-dimethyl- Triazinate 3-[[2-chloro-4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenoxy]methyl]-N,N-dimethylbenzamide 3-[[2-chloro-4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenoxy]methyl]-N,N-dimethyl-benzamide 3-[[4-[4,6-bis(azanyl)-2,2-dimethyl-1,3,5-triazin-1-yl]-2-chloranyl-phenoxy]methyl]-N,N-dimethyl-benzamide
Wiley ID	1112159