5-(4-bromophenyl)-6-methyl-3-[(2-methylphenyl)methyl]thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 5-(4-bromophenyl)-6-methyl-3-[(2-methylphenyl)methyl]thieno[2,3-d]pyrimidin-4-one Openeye Name: 5-(4-bromophenyl)-6-methyl-3-(o-tolylmethyl)thieno[2,3-d]pyrimidin-4-one CAS Name: 5-(4-bromophenyl)-6-methyl-3-[(2-methylphenyl)methyl]-4-thieno[2,3-d]pyrimidinone IUPAC Name: 5-(4-bromophenyl)-6-methyl-3-[(2-methylphenyl)methyl]thieno[2,3-d]pyrimidin-4-one Traditional Name: 5-(4-bromophenyl)-6-methyl-3-(2-methylbenzyl)thieno[2,3-d]pyrimidin-4-one Formula: C21H17BrN2OS MolecularWeight: 425.34148

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN2C=NC3=C(C2=O)C(=C(S3)C)C4=CC=C(C=C4)Br

Isomeric SMILES

CC1=CC=CC=C1CN2C=NC3=C(C2=O)C(=C(S3)C)C4=CC=C(C=C4)Br

InChI

InChI=1S/C21H17BrN2OS/c1-13-5-3-4-6-16(13)11-24-12-23-20-19(21(24)25)18(14(2)26-20)15-7-9-17(22)10-8-15/h3-10,12H,11H2,1-2H3