N-[(4-fluoranyl-3-methyl-phenyl)methyl]-2-(1-oxidanylidene-4-thiophen-2-yl-phthalazin-2-yl)ethanamide

Systemtic Name: N-[(4-fluoranyl-3-methyl-phenyl)methyl]-2-(1-oxidanylidene-4-thiophen-2-yl-phthalazin-2-yl)ethanamide Openeye Name: N-[(4-fluoro-3-methyl-phenyl)methyl]-2-[1-oxo-4-(2-thienyl)phthalazin-2-yl]acetamide CAS Name: N-[(4-fluoro-3-methylphenyl)methyl]-2-(1-oxo-4-thiophen-2-yl-2-phthalazinyl)acetamide IUPAC Name: N-[(4-fluoro-3-methylphenyl)methyl]-2-(1-oxo-4-thiophen-2-ylphthalazin-2-yl)acetamide Traditional Name: N-(4-fluoro-3-methyl-benzyl)-2-[1-keto-4-(2-thienyl)phthalazin-2-yl]acetamide Formula: C22H18FN3O2S MolecularWeight: 407.460623

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)CNC(=O)CN2C(=O)C3=CC=CC=C3C(=N2)C4=CC=CS4)F

Isomeric SMILES

CC1=C(C=CC(=C1)CNC(=O)CN2C(=O)C3=CC=CC=C3C(=N2)C4=CC=CS4)F

InChI

InChI=1S/C22H18FN3O2S/c1-14-11-15(8-9-18(14)23)12-24-20(27)13-26-22(28)17-6-3-2-5-16(17)21(25-26)19-7-4-10-29-19/h2-11H,12-13H2,1H3,(H,24,27)