2-[4-(3-methylphenoxy)butylsulfanyl]-5-(4-methylphenyl)-3H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 2-[4-(3-methylphenoxy)butylsulfanyl]-5-(4-methylphenyl)-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-[4-(3-methylphenoxy)butylsulfanyl]-5-(p-tolyl)-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 2-[4-(3-methylphenoxy)butylthio]-5-(4-methylphenyl)-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 2-[4-(3-methylphenoxy)butylsulfanyl]-5-(4-methylphenyl)-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 2-[4-(3-methylphenoxy)butylthio]-5-(p-tolyl)-3H-thieno[2,3-d]pyrimidin-4-one Formula: C24H24N2O2S2 MolecularWeight: 436.58956

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CSC3=C2C(=O)NC(=N3)SCCCCOC4=CC=CC(=C4)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=CSC3=C2C(=O)NC(=N3)SCCCCOC4=CC=CC(=C4)C

InChI

InChI=1S/C24H24N2O2S2/c1-16-8-10-18(11-9-16)20-15-30-23-21(20)22(27)25-24(26-23)29-13-4-3-12-28-19-7-5-6-17(2)14-19/h5-11,14-15H,3-4,12-13H2,1-2H3,(H,25,26,27)