N-(4-bromanyl-2-methyl-phenyl)-2-(4-oxidanylidenethieno[2,3-d]pyrimidin-3-yl)ethanamide

Systemtic Name: N-(4-bromanyl-2-methyl-phenyl)-2-(4-oxidanylidenethieno[2,3-d]pyrimidin-3-yl)ethanamide Openeye Name: N-(4-bromo-2-methyl-phenyl)-2-(4-oxothieno[2,3-d]pyrimidin-3-yl)acetamide CAS Name: N-(4-bromo-2-methylphenyl)-2-(4-oxo-3-thieno[2,3-d]pyrimidinyl)acetamide IUPAC Name: N-(4-bromo-2-methylphenyl)-2-(4-oxothieno[2,3-d]pyrimidin-3-yl)acetamide Traditional Name: N-(4-bromo-2-methyl-phenyl)-2-(4-ketothieno[2,3-d]pyrimidin-3-yl)acetamide Formula: C15H12BrN3O2S MolecularWeight: 378.24368

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)NC(=O)CN2C=NC3=C(C2=O)C=CS3

Isomeric SMILES

CC1=C(C=CC(=C1)Br)NC(=O)CN2C=NC3=C(C2=O)C=CS3

InChI

InChI=1S/C15H12BrN3O2S/c1-9-6-10(16)2-3-12(9)18-13(20)7-19-8-17-14-11(15(19)21)4-5-22-14/h2-6,8H,7H2,1H3,(H,18,20)