4-(5-bromanyl-4-methyl-thiophen-2-yl)-2H-phthalazin-1-one

Systemtic Name: 4-(5-bromanyl-4-methyl-thiophen-2-yl)-2H-phthalazin-1-one Openeye Name: 4-(5-bromo-4-methyl-2-thienyl)-2H-phthalazin-1-one CAS Name: 4-(5-bromo-4-methyl-2-thiophenyl)-2H-phthalazin-1-one IUPAC Name: 4-(5-bromo-4-methylthiophen-2-yl)-2H-phthalazin-1-one Traditional Name: 4-(5-bromo-4-methyl-2-thienyl)-2H-phthalazin-1-one Formula: C13H9BrN2OS MolecularWeight: 321.19236

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1)C2=NNC(=O)C3=CC=CC=C32)Br

Isomeric SMILES

CC1=C(SC(=C1)C2=NNC(=O)C3=CC=CC=C32)Br

InChI

InChI=1S/C13H9BrN2OS/c1-7-6-10(18-12(7)14)11-8-4-2-3-5-9(8)13(17)16-15-11/h2-6H,1H3,(H,16,17)