1H-imidazole-1-acetic acid, 2-[[2-[(1,1-dimethylethyl)amino]-2-oxoethyl]thio]-4-(4-nitrophenyl)-, methyl ester

SpectraBase Compound ID	7kyLvqZc7Tz
InChI	InChI=1S/C18H22N4O5S/c1-18(2,3)20-15(23)11-28-17-19-14(9-21(17)10-16(24)27-4)12-5-7-13(8-6-12)22(25)26/h5-9H,10-11H2,1-4H3,(H,20,23)
InChIKey	OGDBFUNTEZLLPN-UHFFFAOYSA-N Google Search
Mol Weight	406.46 g/mol
Molecular Formula	C18H22N4O5S
Exact Mass	406.131091 g/mol

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SpectraBase Spectrum ID	4Gha6kgKjl7
Name	2-[2-[[2-(tert-butylamino)-2-keto-ethyl]thio]-4-(4-nitrophenyl)imidazol-1-yl]acetic acid methyl ester
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C18H22N4O5S
InChI	InChI=1S/C18H22N4O5S/c1-18(2,3)20-15(23)11-28-17-19-14(9-21(17)10-16(24)27-4)12-5-7-13(8-6-12)22(25)26/h5-9H,10-11H2,1-4H3,(H,20,23)
InChIKey	OGDBFUNTEZLLPN-UHFFFAOYSA-N
Molecular Weight	406.457 g/mol
SMILES	N(C(CSc1nc(-c2ccc(N(=O)=O)cc2)c[n]1CC(=O)OC)=O)C(C)(C)C
SPLASH	splash10-0a4i-9754000000-310e0fd3c47e4bf6930d
Synonyms	2-[2-[[2-(tert-butylamino)-2-oxoethyl]thio]-4-(4-nitrophenyl)-1-imidazolyl]acetic acid methyl ester Methyl 2-[2-[2-(tert-butylamino)-2-oxidanylidene-ethyl]sulfanyl-4-(4-nitrophenyl)imidazol-1-yl]ethanoate Methyl 2-[2-[2-(tert-butylamino)-2-oxo-ethyl]sulfanyl-4-(4-nitrophenyl)imidazol-1-yl]acetate
Wiley ID	1436862