N-[5-(4-ethylsulfanylphthalazin-1-yl)-2-methyl-phenyl]-4-fluoranyl-benzamide

Systemtic Name: N-[5-(4-ethylsulfanylphthalazin-1-yl)-2-methyl-phenyl]-4-fluoranyl-benzamide Openeye Name: N-[5-(4-ethylsulfanylphthalazin-1-yl)-2-methyl-phenyl]-4-fluoro-benzamide CAS Name: N-[5-[4-(ethylthio)-1-phthalazinyl]-2-methylphenyl]-4-fluorobenzamide IUPAC Name: N-[5-(4-ethylsulfanylphthalazin-1-yl)-2-methylphenyl]-4-fluorobenzamide Traditional Name: N-[5-[4-(ethylthio)phthalazin-1-yl]-2-methyl-phenyl]-4-fluoro-benzamide Formula: C24H20FN3OS MolecularWeight: 417.498503

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NN=C(C2=CC=CC=C21)C3=CC(=C(C=C3)C)NC(=O)C4=CC=C(C=C4)F

Isomeric SMILES

CCSC1=NN=C(C2=CC=CC=C21)C3=CC(=C(C=C3)C)NC(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C24H20FN3OS/c1-3-30-24-20-7-5-4-6-19(20)22(27-28-24)17-9-8-15(2)21(14-17)26-23(29)16-10-12-18(25)13-11-16/h4-14H,3H2,1-2H3,(H,26,29)