CHEBI:107920 - 2-amino-4-[5-methyl-2-(methylthio)-3-thiophenyl]-5-oxo-1-(3-pyridinyl)-4,6,7,8-tetrahydroquinoline-3-carbonitrile

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ChEBI Name 2-amino-4-[5-methyl-2-(methylthio)-3-thiophenyl]-5-oxo-1-(3-pyridinyl)-4,6,7,8-tetrahydroquinoline-3-carbonitrile
ChEBI ID CHEBI:107920
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C21H20N4OS2
Net Charge 0
Average Mass 408.543
Monoisotopic Mass 408.10785
InChI InChI=1S/C21H20N4OS2/c1-12-9-14(21(27-2)28-12)18-15(10-22)20(23)25(13-5-4-8-24-11-13)16-6-3-7-17(26)19(16)18/h4-5,8-9,11,18H,3,6-7,23H2,1-2H3
InChIKey PVRHEORPXRBKLG-UHFFFAOYSA-N
SMILES CC1=CC(=C(S1)SC)C2C(=C(N(C3=C2C(=O)CCC3)C4=CN=CC=C4)N)C#N
ChEBI Ontology
Outgoing 2-amino-4-[5-methyl-2-(methylthio)-3-thiophenyl]-5-oxo-1-(3-pyridinyl)-4,6,7,8-tetrahydroquinoline-3-carbonitrile (CHEBI:107920) is a aryl sulfide (CHEBI:35683)
Manual Xref Database
LSM-19297 LINCS
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