2-[(5,6-dimethyl-4-oxidanylidene-3H-thieno[2,3-d]pyrimidin-2-yl)methylsulfanyl]-N-hexyl-propanamide

Systemtic Name: 2-[(5,6-dimethyl-4-oxidanylidene-3H-thieno[2,3-d]pyrimidin-2-yl)methylsulfanyl]-N-hexyl-propanamide Openeye Name: 2-[(5,6-dimethyl-4-oxo-3H-thieno[2,3-d]pyrimidin-2-yl)methylsulfanyl]-N-hexyl-propanamide CAS Name: 2-[(5,6-dimethyl-4-oxo-3H-thieno[2,3-d]pyrimidin-2-yl)methylthio]-N-hexylpropanamide IUPAC Name: 2-[(5,6-dimethyl-4-oxo-3H-thieno[2,3-d]pyrimidin-2-yl)methylsulfanyl]-N-hexylpropanamide Traditional Name: N-hexyl-2-[(4-keto-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-2-yl)methylthio]propionamide Formula: C18H27N3O2S2 MolecularWeight: 381.55588

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCNC(=O)C(C)SCC1=NC2=C(C(=C(S2)C)C)C(=O)N1

Isomeric SMILES

CCCCCCNC(=O)C(C)SCC1=NC2=C(C(=C(S2)C)C)C(=O)N1

InChI

InChI=1S/C18H27N3O2S2/c1-5-6-7-8-9-19-16(22)13(4)24-10-14-20-17(23)15-11(2)12(3)25-18(15)21-14/h13H,5-10H2,1-4H3,(H,19,22)(H,20,21,23)