6-methyl-5-(2-methylbutyl)-2-(oxan-2-ylmethylsulfanyl)-3H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 6-methyl-5-(2-methylbutyl)-2-(oxan-2-ylmethylsulfanyl)-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 6-methyl-5-(2-methylbutyl)-2-(tetrahydropyran-2-ylmethylsulfanyl)-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 6-methyl-5-(2-methylbutyl)-2-(2-oxanylmethylthio)-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 6-methyl-5-(2-methylbutyl)-2-(oxan-2-ylmethylsulfanyl)-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 6-methyl-5-(2-methylbutyl)-2-(tetrahydropyran-2-ylmethylthio)-3H-thieno[2,3-d]pyrimidin-4-one Formula: C18H26N2O2S2 MolecularWeight: 366.54124

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)CC1=C(SC2=C1C(=O)NC(=N2)SCC3CCCCO3)C

Isomeric SMILES

CCC(C)CC1=C(SC2=C1C(=O)NC(=N2)SCC3CCCCO3)C

InChI

InChI=1S/C18H26N2O2S2/c1-4-11(2)9-14-12(3)24-17-15(14)16(21)19-18(20-17)23-10-13-7-5-6-8-22-13/h11,13H,4-10H2,1-3H3,(H,19,20,21)