N-(5-tert-butyl-2-oxidanyl-phenyl)-2-[(4-oxidanylidene-5-phenyl-3H-thieno[2,3-d]pyrimidin-2-yl)methylsulfanyl]propanamide

Systemtic Name: N-(5-tert-butyl-2-oxidanyl-phenyl)-2-[(4-oxidanylidene-5-phenyl-3H-thieno[2,3-d]pyrimidin-2-yl)methylsulfanyl]propanamide Openeye Name: N-(5-tert-butyl-2-hydroxy-phenyl)-2-[(4-oxo-5-phenyl-3H-thieno[2,3-d]pyrimidin-2-yl)methylsulfanyl]propanamide CAS Name: N-(5-tert-butyl-2-hydroxyphenyl)-2-[(4-oxo-5-phenyl-3H-thieno[2,3-d]pyrimidin-2-yl)methylthio]propanamide IUPAC Name: N-(5-tert-butyl-2-hydroxyphenyl)-2-[(4-oxo-5-phenyl-3H-thieno[2,3-d]pyrimidin-2-yl)methylsulfanyl]propanamide Traditional Name: N-(5-tert-butyl-2-hydroxy-phenyl)-2-[(4-keto-5-phenyl-3H-thieno[2,3-d]pyrimidin-2-yl)methylthio]propionamide Formula: C26H27N3O3S2 MolecularWeight: 493.64088

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C=CC(=C1)C(C)(C)C)O)SCC2=NC3=C(C(=CS3)C4=CC=CC=C4)C(=O)N2

Isomeric SMILES

CC(C(=O)NC1=C(C=CC(=C1)C(C)(C)C)O)SCC2=NC3=C(C(=CS3)C4=CC=CC=C4)C(=O)N2

InChI

InChI=1S/C26H27N3O3S2/c1-15(23(31)27-19-12-17(26(2,3)4)10-11-20(19)30)33-14-21-28-24(32)22-18(13-34-25(22)29-21)16-8-6-5-7-9-16/h5-13,15,30H,14H2,1-4H3,(H,27,31)(H,28,29,32)