3-(4-bromophenyl)-2-[(4-tert-butylphenyl)methylsulfanyl]thieno[3,2-d]pyrimidin-4-one

Systemtic Name: 3-(4-bromophenyl)-2-[(4-tert-butylphenyl)methylsulfanyl]thieno[3,2-d]pyrimidin-4-one Openeye Name: 3-(4-bromophenyl)-2-[(4-tert-butylphenyl)methylsulfanyl]thieno[3,2-d]pyrimidin-4-one CAS Name: 3-(4-bromophenyl)-2-[(4-tert-butylphenyl)methylthio]-4-thieno[3,2-d]pyrimidinone IUPAC Name: 3-(4-bromophenyl)-2-[(4-tert-butylphenyl)methylsulfanyl]thieno[3,2-d]pyrimidin-4-one Traditional Name: 3-(4-bromophenyl)-2-[(4-tert-butylbenzyl)thio]thieno[3,2-d]pyrimidin-4-one Formula: C23H21BrN2OS2 MolecularWeight: 485.45964

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)CSC2=NC3=C(C(=O)N2C4=CC=C(C=C4)Br)SC=C3

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)CSC2=NC3=C(C(=O)N2C4=CC=C(C=C4)Br)SC=C3

InChI

InChI=1S/C23H21BrN2OS2/c1-23(2,3)16-6-4-15(5-7-16)14-29-22-25-19-12-13-28-20(19)21(27)26(22)18-10-8-17(24)9-11-18/h4-13H,14H2,1-3H3