1H-1,2,4-Triazole-1,4(5H)-dicarboxylic acid, 5-[6-(1,3-dioxolo[4,5-g]quinazolin-8-ylamino)-1,3-benzodioxol-5-yl]-, diethyl ester

SpectraBase Compound ID	8UUqVw1yhR5
InChI	InChI=1S/C24H22N6O8/c1-3-33-23(31)29-10-27-30(24(32)34-4-2)22(29)14-6-18-20(38-12-36-18)8-16(14)28-21-13-5-17-19(37-11-35-17)7-15(13)25-9-26-21/h5-10,22H,3-4,11-12H2,1-2H3,(H,25,26,28)
InChIKey	XRSWFXAQULCZJH-UHFFFAOYSA-N Google Search
Mol Weight	522.47 g/mol
Molecular Formula	C24H22N6O8
Exact Mass	522.149912 g/mol

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SpectraBase Spectrum ID	DvMfHaDhp1c
Name	1H-1,2,4-Triazole-1,4(5H)-dicarboxylic acid, 5-[6-(1,3-dioxolo[4,5-g]quinazolin-8-ylamino)-1,3-benzodioxol-5-yl]-, diethyl ester
Alternate Name(s)	1,3-Dioxolo[4,5-g]quinazoline, 1H-1,2,4-triazole-1,4(5H)-dicarboxylic acid deriv. Diethyl 5-[4,5-methylenedioxy-2-(6,7-methylenedioxyquinazolin-4-ylamino)phenyl-.delta.2-1,2,4-triazoline-1,4-dicarboxylate Diethyl 5-[6-([1,3]dioxolo[4,5-g]quinazolin-8-ylamino)-1,3-benzodioxol-5-yl]-1H-1,2,4-triazole-1,4(5H)-dicarboxylate
CAS Registry Number	87880-44-2
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C24H22N6O8
InChI	InChI=1S/C24H22N6O8/c1-3-33-23(31)29-10-27-30(24(32)34-4-2)22(29)14-6-18-20(38-12-36-18)8-16(14)28-21-13-5-17-19(37-11-35-17)7-15(13)25-9-26-21/h5-10,22H,3-4,11-12H2,1-2H3,(H,25,26,28)
InChIKey	XRSWFXAQULCZJH-UHFFFAOYSA-N
Molecular Weight	522.474 g/mol
SMILES	N(c1c2c(cc3c(c2)OCO3)ncn1)c1c(C2N(N=CN2C(=O)OCC)C(=O)OCC)cc2c(OCO2)c1
SPLASH	splash10-0ab9-0109600000-837d974df840bd3d400f
Source of Spectrum	KC-1983-2008-0
Wiley ID	1402203