5-ethyl-N-((1S)-3-(methylsulfanyl)-1-{[(4-pyridinylmethyl)amino]carbonyl}propyl)-8-oxo-5,8-dihydro[1,3]dioxolo[4,5-g]quinoline-7-carboxamide

SpectraBase Compound ID	L4dUVTZei3j
InChI	InChI=1S/C24H26N4O5S/c1-3-28-13-17(22(29)16-10-20-21(11-19(16)28)33-14-32-20)23(30)27-18(6-9-34-2)24(31)26-12-15-4-7-25-8-5-15/h4-5,7-8,10-11,13,18H,3,6,9,12,14H2,1-2H3,(H,26,31)(H,27,30)
InChIKey	XPKVKMCHALQKAE-UHFFFAOYSA-N Google Search
Mol Weight	482.56 g/mol
Molecular Formula	C24H26N4O5S
Exact Mass	482.162391 g/mol

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SpectraBase Spectrum ID	7qIMjnIJrYU
Name	5-ethyl-N-((1S)-3-(methylsulfanyl)-1-{[(4-pyridinylmethyl)amino]carbonyl}propyl)-8-oxo-5,8-dihydro[1,3]dioxolo[4,5-g]quinoline-7-carboxamide
Author	A.V.Yarkov, IPAC, Russia
Copyright	Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI	InChI=1S/C24H26N4O5S/c1-3-28-13-17(22(29)16-10-20-21(11-19(16)28)33-14-32-20)23(30)27-18(6-9-34-2)24(31)26-12-15-4-7-25-8-5-15/h4-5,7-8,10-11,13,18H,3,6,9,12,14H2,1-2H3,(H,26,31)(H,27,30)
InChIKey	XPKVKMCHALQKAE-UHFFFAOYSA-N
NMR Offset	15.449
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_36227_36032
Owner	Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State	soluted
Solvent	DMSO-d6
Source File Reference	VendorID: E98510; SBI_ID: SBI-036036
Synonyms	5-ethyl-N-(3-(methylsulfanyl)-1-{[(4-pyridinylmethyl)amino]carbonyl}propyl)-8-oxo-5,8-dihydro[1,3]dioxolo[4,5-g]quinoline-7-carboxamide
Temperature	308 °C