2-[(4-bromanyl-2-chloranyl-phenoxy)methyl]-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 2-[(4-bromanyl-2-chloranyl-phenoxy)methyl]-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-[(4-bromo-2-chloro-phenoxy)methyl]-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 2-[(4-bromo-2-chlorophenoxy)methyl]-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 2-[(4-bromo-2-chlorophenoxy)methyl]-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 2-[(4-bromo-2-chloro-phenoxy)methyl]-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one Formula: C19H12BrClN2O2S MolecularWeight: 447.73278

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CSC3=C2C(=O)NC(=N3)COC4=C(C=C(C=C4)Br)Cl

Isomeric SMILES

C1=CC=C(C=C1)C2=CSC3=C2C(=O)NC(=N3)COC4=C(C=C(C=C4)Br)Cl

InChI

InChI=1S/C19H12BrClN2O2S/c20-12-6-7-15(14(21)8-12)25-9-16-22-18(24)17-13(10-26-19(17)23-16)11-4-2-1-3-5-11/h1-8,10H,9H2,(H,22,23,24)