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ETHYL-2-[(1'H-BENZO-[D]-IMIDAZOL-2'-YL)-METHYLTHIO]-4-AMINO-5-(1'H-BENZO-[D]-IMIDAZOL-2'-YL)-THIOPHENE-3-CARBOXYLATE
SpectraBase Compound ID JKF6oxRUIuL
InChI InChI=1S/C22H19N5O2S2/c1-2-29-21(28)17-18(23)19(20-26-14-9-5-6-10-15(14)27-20)31-22(17)30-11-16-24-12-7-3-4-8-13(12)25-16/h3-10H,2,11,23H2,1H3,(H,24,25)(H,26,27)
InChIKey XSEZZOLSYHUDSF-UHFFFAOYSA-N
Mol Weight 449.55 g/mol
Molecular Formula C22H19N5O2S2
Exact Mass 449.098017 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1WCea7Sv6jL
Name ETHYL-2-[(1'H-BENZO-[D]-IMIDAZOL-2'-YL)-METHYLTHIO]-4-AMINO-5-(1'H-BENZO-[D]-IMIDAZOL-2'-YL)-THIOPHENE-3-CARBOXYLATE
Compound Number 9
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H19N5O2S2
InChI InChI=1S/C22H19N5O2S2/c1-2-29-21(28)17-18(23)19(20-26-14-9-5-6-10-15(14)27-20)31-22(17)30-11-16-24-12-7-3-4-8-13(12)25-16/h3-10H,2,11,23H2,1H3,(H,24,25)(H,26,27)
InChIKey XSEZZOLSYHUDSF-UHFFFAOYSA-N
Literature Reference Author V.PADMAVATHI,B.C.VENKATESH,A.MURALIKRISHNA,A.PADMAJA
Literature Reference Citation CHEM.PHARM.BULL.,60,449(2012)
Literature Reference DOI 10.1248/cpb.60.449
Molecular Weight 449.545 g/mol
Source File Reference UWBT4704