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2-[(4-Amino-3-phenyl-2-thioxo-2,3-dihydrothiazol-5-yl)]benzimidazole-5-carboxylic acid
SpectraBase Compound ID 6Fg9CAmAabB
InChI InChI=1S/C17H12N4O2S2/c18-14-13(25-17(24)21(14)10-4-2-1-3-5-10)15-19-11-7-6-9(16(22)23)8-12(11)20-15/h1-8H,18H2,(H,19,20)(H,22,23)
InChIKey SSBFOQNWZWLAIU-UHFFFAOYSA-N
Mol Weight 368.43 g/mol
Molecular Formula C17H12N4O2S2
Exact Mass 368.040168 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3SoxfavtDRf
Name 2-[(4-Amino-3-phenyl-2-thioxo-2,3-dihydrothiazol-5-yl)]benzimidazole-5-carboxylic acid
Alternate Name(s) 2-(4-amino-3-phenyl-2-sulfanylidene-5-thiazolyl)-3H-benzimidazole-5-carboxylic acid 2-(4-amino-3-phenyl-2-sulfanylidene-1,3-thiazol-5-yl)-3H-benzimidazole-5-carboxylic acid 2-(4-amino-3-phenyl-2-thioxo-thiazol-5-yl)-3H-benzimidazole-5-carboxylic acid 2-(4-azanyl-3-phenyl-2-sulfanylidene-1,3-thiazol-5-yl)-3H-benzimidazole-5-carboxylic acid
Comments Less than 3 mono-isotopic peaks
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Formula C17H12N4O2S2
InChI InChI=1S/C17H12N4O2S2/c18-14-13(25-17(24)21(14)10-4-2-1-3-5-10)15-19-11-7-6-9(16(22)23)8-12(11)20-15/h1-8H,18H2,(H,19,20)(H,22,23)
InChIKey SSBFOQNWZWLAIU-UHFFFAOYSA-N
Molecular Weight 368.429 g/mol
SMILES NC1=C(c2nc3cc(C(=O)O)ccc3[nH]2)SC(N1c1ccccc1)=S
SPLASH splash10-014i-0009000000-241b42f388b19f3da3fe
Source of Spectrum F2-45-2953-3b
Wiley ID 1689336