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N-(4-CHLORO-1,3-BENZOTHIAZOL-2-YL)-N'-(2-THIOXO-2,3-DIHYDRO-2-LAMBDA(5)-PYRIDO-[2,3-D]-[1,3,2]-OXAZA-PHOSPHOL-2-YL)-GUANIDINE

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N-(4-CHLORO-1,3-BENZOTHIAZOL-2-YL)-N'-(2-THIOXO-2,3-DIHYDRO-2-LAMBDA(5)-PYRIDO-[2,3-D]-[1,3,2]-OXAZA-PHOSPHOL-2-YL)-GUANIDINE
SpectraBase Compound ID GJ8gNNYc1tT
InChI InChI=1S/C13H11ClN7OPS2/c14-7-3-4-10-8(6-7)17-13(25-10)19-18-12(15)21-23(24)20-11-9(22-23)2-1-5-16-11/h1-6H,(H,17,19)(H4,15,16,18,20,21,24)
InChIKey ISFSSSDRILYYMT-UHFFFAOYSA-N
Mol Weight 411.83 g/mol
Molecular Formula C13H11ClN7OPS2
Exact Mass 410.989265 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3Q765n7l3xJ
Name N-(4-CHLORO-1,3-BENZOTHIAZOL-2-YL)-N'-(2-THIOXO-2,3-DIHYDRO-2-LAMBDA(5)-PYRIDO-[2,3-D]-[1,3,2]-OXAZA-PHOSPHOL-2-YL)-GUANIDINE
Compound Number 5B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H11ClN7OPS2
InChI InChI=1S/C13H11ClN7OPS2/c14-7-3-4-10-8(6-7)17-13(25-10)19-18-12(15)21-23(24)20-11-9(22-23)2-1-5-16-11/h1-6H,(H,17,19)(H4,15,16,18,20,21,24)
InChIKey ISFSSSDRILYYMT-UHFFFAOYSA-N
Literature Reference Author V.R.KATLA,R.SYED,R.SYED,C.S.KURUVA,H.K.KUNTRAPAKAM,N.R.CHAMA RTHI
Literature Reference Citation CHEM.PHARM.BULL.,61,25(2013)
Literature Reference DOI 10.1248/cpb.c12-00582
Molecular Weight 411.823 g/mol
Source File Reference UWBT4804