5-(2-bromanyl-5-methyl-phenyl)-2-[(4-chlorophenyl)methyl]-6-methyl-3H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 5-(2-bromanyl-5-methyl-phenyl)-2-[(4-chlorophenyl)methyl]-6-methyl-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 5-(2-bromo-5-methyl-phenyl)-2-[(4-chlorophenyl)methyl]-6-methyl-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 5-(2-bromo-5-methylphenyl)-2-[(4-chlorophenyl)methyl]-6-methyl-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 5-(2-bromo-5-methylphenyl)-2-[(4-chlorophenyl)methyl]-6-methyl-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 5-(2-bromo-5-methyl-phenyl)-2-(4-chlorobenzyl)-6-methyl-3H-thieno[2,3-d]pyrimidin-4-one Formula: C21H16BrClN2OS MolecularWeight: 459.78654

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)Br)C2=C(SC3=C2C(=O)NC(=N3)CC4=CC=C(C=C4)Cl)C

Isomeric SMILES

CC1=CC(=C(C=C1)Br)C2=C(SC3=C2C(=O)NC(=N3)CC4=CC=C(C=C4)Cl)C

InChI

InChI=1S/C21H16BrClN2OS/c1-11-3-8-16(22)15(9-11)18-12(2)27-21-19(18)20(26)24-17(25-21)10-13-4-6-14(23)7-5-13/h3-9H,10H2,1-2H3,(H,24,25,26)