3-[5-(4-bromophenyl)-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl]propanoate

Systemtic Name: 3-[5-(4-bromophenyl)-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl]propanoate Openeye Name: 3-[5-(4-bromophenyl)-4-oxo-thieno[2,3-d]pyrimidin-3-yl]propanoate CAS Name: 3-[5-(4-bromophenyl)-4-oxo-3-thieno[2,3-d]pyrimidinyl]propanoate IUPAC Name: 3-[5-(4-bromophenyl)-4-oxothieno[2,3-d]pyrimidin-3-yl]propanoate Traditional Name: 3-[5-(4-bromophenyl)-4-keto-thieno[2,3-d]pyrimidin-3-yl]propionate Formula: C15H10BrN2O3S- MolecularWeight: 378.2205

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=CSC3=C2C(=O)N(C=N3)CCC(=O)[O-])Br

Isomeric SMILES

C1=CC(=CC=C1C2=CSC3=C2C(=O)N(C=N3)CCC(=O)[O-])Br

InChI

InChI=1S/C15H11BrN2O3S/c16-10-3-1-9(2-4-10)11-7-22-14-13(11)15(21)18(8-17-14)6-5-12(19)20/h1-4,7-8H,5-6H2,(H,19,20)/p-1