CHEBI:104918 - 2-[[[4-cyclohexyl-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]thio]methyl]-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one

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ChEBI Name 2-[[[4-cyclohexyl-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]thio]methyl]-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one
ChEBI ID CHEBI:104918
Stars This entity has been manually annotated by a third party.
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Formula C22H25N5OS3
Net Charge 0
Average Mass 471.666
Monoisotopic Mass 471.12212
InChI InChI=1S/C22H25N5OS3/c1-13-14(2)31-21-19(13)20(28)23-17(24-21)12-30-22-26-25-18(11-16-9-6-10-29-16)27(22)15-7-4-3-5-8-15/h6,9-10,15H,3-5,7-8,11-12H2,1-2H3,(H,23,24,28)
InChIKey JWXFOJJHFNTLGM-UHFFFAOYSA-N
SMILES CC1=C(SC2=C1C(=O)NC(=N2)CSC3=NN=C(N3C4CCCCC4)CC5=CC=CS5)C
ChEBI Ontology
Outgoing 2-[[[4-cyclohexyl-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]thio]methyl]-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one (CHEBI:104918) is a organic heterobicyclic compound (CHEBI:27171)
2-[[[4-cyclohexyl-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]thio]methyl]-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one (CHEBI:104918) is a organonitrogen heterocyclic compound (CHEBI:38101)
2-[[[4-cyclohexyl-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]thio]methyl]-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one (CHEBI:104918) is a organosulfur heterocyclic compound (CHEBI:38106)
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