CHEBI:108001 - 4-[[7-methyl-4-(phenylthio)-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl]methyl]morpholine

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ChEBI Name 4-[[7-methyl-4-(phenylthio)-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl]methyl]morpholine
ChEBI ID CHEBI:108001
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C22H25N3OS2
Net Charge 0
Average Mass 411.586
Monoisotopic Mass 411.14390
InChI InChI=1S/C22H25N3OS2/c1-15-7-8-17-18(13-15)28-22-20(17)21(27-16-5-3-2-4-6-16)23-19(24-22)14-25-9-11-26-12-10-25/h2-6,15H,7-14H2,1H3
InChIKey URCOLTFOBLDFKR-UHFFFAOYSA-N
SMILES CC1CCC2=C(C1)SC3=C2C(=NC(=N3)CN4CCOCC4)SC5=CC=CC=C5
ChEBI Ontology
Outgoing 4-[[7-methyl-4-(phenylthio)-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl]methyl]morpholine (CHEBI:108001) is a aryl sulfide (CHEBI:35683)
Manual Xref Database
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