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(5Z)-5-(1H-benzimidazol-2-ylmethylene)-1-[2-(cyclohexen-1-yl)ethyl]-2-thioxo-hexahydropyrimidine-4,6-dione
SpectraBase Compound ID 3iZzXgEzrmT
InChI InChI=1S/C20H20N4O2S/c25-18-14(12-17-21-15-8-4-5-9-16(15)22-17)19(26)24(20(27)23-18)11-10-13-6-2-1-3-7-13/h4-6,8-9,12H,1-3,7,10-11H2,(H,21,22)(H,23,25,27)/b14-12-
InChIKey ISHBKOHSXYEZGJ-OWBHPGMISA-N
Mol Weight 380.47 g/mol
Molecular Formula C20H20N4O2S
Exact Mass 380.130697 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID I39tYWPjyWW
Name (5Z)-5-(1H-benzimidazol-2-ylmethylene)-1-[2-(cyclohexen-1-yl)ethyl]-2-thioxo-hexahydropyrimidine-4,6-dione
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H20N4O2S
InChI InChI=1S/C20H20N4O2S/c25-18-14(12-17-21-15-8-4-5-9-16(15)22-17)19(26)24(20(27)23-18)11-10-13-6-2-1-3-7-13/h4-6,8-9,12H,1-3,7,10-11H2,(H,21,22)(H,23,25,27)/b14-12-
InChIKey ISHBKOHSXYEZGJ-OWBHPGMISA-N
Molecular Weight 380.466 g/mol
SMILES N1C(\C(=C\c2nc3ccccc3[nH]2)C(N(C1=S)CCC1=CCCCC1)=O)=O
SPLASH splash10-00dj-3941000000-63043f2a8dcec4ba6280
Synonyms (5Z)-5-(1H-benzimidazol-2-ylmethylene)-1-[2-(cyclohexen-1-yl)ethyl]-2-thioxo-hexahydropyrimidine-4,6-quinone (5Z)-5-(1H-benzimidazol-2-ylmethylidene)-1-[2-(1-cyclohexenyl)ethyl]-2-sulfanylidene-1,3-diazinane-4,6-dione (5Z)-5-(1H-benzimidazol-2-ylmethylidene)-1-[2-(cyclohexen-1-yl)ethyl]-2-sulfanylidene-1,3-diazinane-4,6-dione
Wiley ID 1453481