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5-Iodo-4-methoxy-9-tosylaminopyrido[3',2':4,5]pyrrolo[1,2-c]pyrimidine
SpectraBase Compound ID 2TnlpILBbB4
InChI InChI=1S/C18H15IN4O3S/c1-11-3-5-12(6-4-11)27(24,25)22-18-21-9-7-13-16(19)15-14(26-2)8-10-20-17(15)23(13)18/h3-10H,1-2H3,(H,21,22)
InChIKey PVJHYETUEVUHPX-UHFFFAOYSA-N
Mol Weight 494.31 g/mol
Molecular Formula C18H15IN4O3S
Exact Mass 493.990957 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID sikxUxNuP
Name 5-Iodo-4-methoxy-9-tosylaminopyrido[3',2':4,5]pyrrolo[1,2-c]pyrimidine
Alternate Name(s) N-(5-iodo-4-methoxy-9-pyrido[1,2]pyrrolo[4,5-c]pyrimidinyl)-4-methylbenzenesulfonamide N-(5-iodo-4-methoxypyrido[1,2]pyrrolo[4,5-c]pyrimidin-9-yl)-4-methylbenzenesulfonamide N-(5-iodanyl-4-methoxy-pyrido[1,2]pyrrolo[4,5-c]pyrimidin-9-yl)-4-methyl-benzenesulfonamide
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Formula C18H15IN4O3S
InChI InChI=1S/C18H15IN4O3S/c1-11-3-5-12(6-4-11)27(24,25)22-18-21-9-7-13-16(19)15-14(26-2)8-10-20-17(15)23(13)18/h3-10H,1-2H3,(H,21,22)
InChIKey PVJHYETUEVUHPX-UHFFFAOYSA-N
Molecular Weight 494.307 g/mol
SMILES N(C=1[n]2c(C=CN1)c(c1c2nccc1OC)I)S(=O)(=O)c1ccc(C)cc1
SPLASH splash10-0ik9-0096300000-8706ffe18850ce1de65a
Source of Spectrum F-68-10029-26
Wiley ID 1574016