2-[2-(4-tert-butylphenoxy)ethylsulfanyl]-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 2-[2-(4-tert-butylphenoxy)ethylsulfanyl]-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-[2-(4-tert-butylphenoxy)ethylsulfanyl]-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 2-[2-(4-tert-butylphenoxy)ethylthio]-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 2-[2-(4-tert-butylphenoxy)ethylsulfanyl]-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 2-[2-(4-tert-butylphenoxy)ethylthio]-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one Formula: C24H24N2O2S2 MolecularWeight: 436.58956

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)OCCSC2=NC3=C(C(=CS3)C4=CC=CC=C4)C(=O)N2

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)OCCSC2=NC3=C(C(=CS3)C4=CC=CC=C4)C(=O)N2

InChI

InChI=1S/C24H24N2O2S2/c1-24(2,3)17-9-11-18(12-10-17)28-13-14-29-23-25-21(27)20-19(15-30-22(20)26-23)16-7-5-4-6-8-16/h4-12,15H,13-14H2,1-3H3,(H,25,26,27)