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

Systemtic Name: 1-[(3-bromophenyl)methyl]-3-oxidanyl-thieno[3,2-d]pyrimidine-2,4-dione Openeye Name: 1-[(3-bromophenyl)methyl]-3-hydroxy-thieno[3,2-d]pyrimidine-2,4-dione CAS Name: 1-[(3-bromophenyl)methyl]-3-hydroxythieno[3,2-d]pyrimidine-2,4-dione IUPAC Name: 1-[(3-bromophenyl)methyl]-3-hydroxythieno[3,2-d]pyrimidine-2,4-dione Traditional Name: 1-(3-bromobenzyl)-3-hydroxy-thieno[3,2-d]pyrimidine-2,4-quinone Formula: C13H9BrN2O3S MolecularWeight: 353.19116

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Br)CN2C3=C(C(=O)N(C2=O)O)SC=C3

Isomeric SMILES

C1=CC(=CC(=C1)Br)CN2C3=C(C(=O)N(C2=O)O)SC=C3

InChI

InChI=1S/C13H9BrN2O3S/c14-9-3-1-2-8(6-9)7-15-10-4-5-20-11(10)12(17)16(19)13(15)18/h1-6,19H,7H2