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Benzoic acid, 4-[[(3-aminothieno[2,3-b]pyridin-2-yl)carbonyl]amino]-, methyl ester
SpectraBase Compound ID AcmD6qQSNYH
InChI InChI=1S/C16H13N3O3S/c1-22-16(21)9-4-6-10(7-5-9)19-14(20)13-12(17)11-3-2-8-18-15(11)23-13/h2-8H,17H2,1H3,(H,19,20)
InChIKey IYJURWZRJOJYLG-UHFFFAOYSA-N
Mol Weight 327.36 g/mol
Molecular Formula C16H13N3O3S
Exact Mass 327.067762 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID E1VbKGLinBj
Name Benzoic acid, 4-[[(3-aminothieno[2,3-b]pyridin-2-yl)carbonyl]amino]-, methyl ester
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Formula C16H13N3O3S
InChI InChI=1S/C16H13N3O3S/c1-22-16(21)9-4-6-10(7-5-9)19-14(20)13-12(17)11-3-2-8-18-15(11)23-13/h2-8H,17H2,1H3,(H,19,20)
InChIKey IYJURWZRJOJYLG-UHFFFAOYSA-N
Molecular Weight 327.358 g/mol
SMILES N(C(c1c(c2cccnc2s1)N)=O)c1ccc(cc1)C(=O)OC
SPLASH splash10-004i-4900000000-37894586e8f91fd5c58c
Source of Spectrum IY-2-4900-5
Synonyms 4-[[(3-amino-2-thieno[2,3-b]pyridinyl)-oxomethyl]amino]benzoic acid methyl ester Methyl 4-[(3-aminothieno[2,3-b]pyridine-2-carbonyl)amino]benzoate Methyl 4-[(3-azanylthieno[2,3-b]pyridin-2-yl)carbonylamino]benzoate
Wiley ID 1656988