3-[(4-bromophenyl)methyl]-5-phenyl-1-(phenylmethyl)thieno[2,3-d]pyrimidine-2,4-dione

Systemtic Name: 3-[(4-bromophenyl)methyl]-5-phenyl-1-(phenylmethyl)thieno[2,3-d]pyrimidine-2,4-dione Openeye Name: 1-benzyl-3-[(4-bromophenyl)methyl]-5-phenyl-thieno[2,3-d]pyrimidine-2,4-dione CAS Name: 3-[(4-bromophenyl)methyl]-5-phenyl-1-(phenylmethyl)thieno[2,3-d]pyrimidine-2,4-dione IUPAC Name: 1-benzyl-3-[(4-bromophenyl)methyl]-5-phenylthieno[2,3-d]pyrimidine-2,4-dione Traditional Name: 1-benzyl-3-(4-bromobenzyl)-5-phenyl-thieno[2,3-d]pyrimidine-2,4-quinone Formula: C26H19BrN2O2S MolecularWeight: 503.41026

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C3=C(C(=CS3)C4=CC=CC=C4)C(=O)N(C2=O)CC5=CC=C(C=C5)Br

Isomeric SMILES

C1=CC=C(C=C1)CN2C3=C(C(=CS3)C4=CC=CC=C4)C(=O)N(C2=O)CC5=CC=C(C=C5)Br

InChI

InChI=1S/C26H19BrN2O2S/c27-21-13-11-19(12-14-21)15-28-24(30)23-22(20-9-5-2-6-10-20)17-32-25(23)29(26(28)31)16-18-7-3-1-4-8-18/h1-14,17H,15-16H2