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

Systemtic Name: 5-(4-bromophenyl)-6-methyl-3-[(3-methylphenyl)methyl]thieno[2,3-d]pyrimidin-4-one Openeye Name: 5-(4-bromophenyl)-6-methyl-3-(m-tolylmethyl)thieno[2,3-d]pyrimidin-4-one CAS Name: 5-(4-bromophenyl)-6-methyl-3-[(3-methylphenyl)methyl]-4-thieno[2,3-d]pyrimidinone IUPAC Name: 5-(4-bromophenyl)-6-methyl-3-[(3-methylphenyl)methyl]thieno[2,3-d]pyrimidin-4-one Traditional Name: 5-(4-bromophenyl)-6-methyl-3-(3-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=C1)CN2C=NC3=C(C2=O)C(=C(S3)C)C4=CC=C(C=C4)Br

Isomeric SMILES

CC1=CC(=CC=C1)CN2C=NC3=C(C2=O)C(=C(S3)C)C4=CC=C(C=C4)Br

InChI

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