2-hexylsulfanyl-6-methyl-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 2-hexylsulfanyl-6-methyl-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-hexylsulfanyl-6-methyl-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 2-(hexylthio)-6-methyl-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 2-hexylsulfanyl-6-methyl-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 2-(hexylthio)-6-methyl-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one Formula: C19H22N2OS2 MolecularWeight: 358.52078

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCSC1=NC2=C(C(=C(S2)C)C3=CC=CC=C3)C(=O)N1

Isomeric SMILES

CCCCCCSC1=NC2=C(C(=C(S2)C)C3=CC=CC=C3)C(=O)N1

InChI

InChI=1S/C19H22N2OS2/c1-3-4-5-9-12-23-19-20-17(22)16-15(13(2)24-18(16)21-19)14-10-7-6-8-11-14/h6-8,10-11H,3-5,9,12H2,1-2H3,(H,20,21,22)