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(5Z)-5-(1H-benzimidazol-2-ylmethylene)-2-thioxo-1-(3,4,5-trimethoxyphenyl)hexahydropyrimidine-4,6-dione
SpectraBase Compound ID 90t7atUcfwe
InChI InChI=1S/C21H18N4O5S/c1-28-15-8-11(9-16(29-2)18(15)30-3)25-20(27)12(19(26)24-21(25)31)10-17-22-13-6-4-5-7-14(13)23-17/h4-10H,1-3H3,(H,22,23)(H,24,26,31)/b12-10-
InChIKey USKUEERLHLJYEG-BENRWUELSA-N
Mol Weight 438.46 g/mol
Molecular Formula C21H18N4O5S
Exact Mass 438.099791 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2sOThnNMA4
Name (5Z)-5-(1H-benzimidazol-2-ylmethylene)-2-thioxo-1-(3,4,5-trimethoxyphenyl)hexahydropyrimidine-4,6-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H18N4O5S
InChI InChI=1S/C21H18N4O5S/c1-28-15-8-11(9-16(29-2)18(15)30-3)25-20(27)12(19(26)24-21(25)31)10-17-22-13-6-4-5-7-14(13)23-17/h4-10H,1-3H3,(H,22,23)(H,24,26,31)/b12-10-
InChIKey USKUEERLHLJYEG-BENRWUELSA-N
Molecular Weight 438.458 g/mol
SMILES N1C(\C(=C\c2nc3ccccc3[nH]2)C(N(C1=S)c1cc(OC)c(c(c1)OC)OC)=O)=O
SPLASH splash10-02wc-1950000000-d4ef46e951b4dd273a08
Synonyms (5Z)-5-(1H-benzimidazol-2-ylmethylene)-2-thioxo-1-(3,4,5-trimethoxyphenyl)hexahydropyrimidine-4,6-quinone (5Z)-5-(1H-benzimidazol-2-ylmethylidene)-2-sulfanylidene-1-(3,4,5-trimethoxyphenyl)-1,3-diazinane-4,6-dione
Wiley ID 1466113