N-[(4-fluorophenyl)methyl]-2-(4-morpholin-4-ylphthalazin-1-yl)sulfanyl-ethanamide

Systemtic Name: N-[(4-fluorophenyl)methyl]-2-(4-morpholin-4-ylphthalazin-1-yl)sulfanyl-ethanamide Openeye Name: N-[(4-fluorophenyl)methyl]-2-(4-morpholinophthalazin-1-yl)sulfanyl-acetamide CAS Name: N-[(4-fluorophenyl)methyl]-2-[[4-(4-morpholinyl)-1-phthalazinyl]thio]acetamide IUPAC Name: N-[(4-fluorophenyl)methyl]-2-(4-morpholin-4-ylphthalazin-1-yl)sulfanylacetamide Traditional Name: N-(4-fluorobenzyl)-2-[(4-morpholinophthalazin-1-yl)thio]acetamide Formula: C21H21FN4O2S MolecularWeight: 412.480443

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=NN=C(C3=CC=CC=C32)SCC(=O)NCC4=CC=C(C=C4)F

Isomeric SMILES

C1COCCN1C2=NN=C(C3=CC=CC=C32)SCC(=O)NCC4=CC=C(C=C4)F

InChI

InChI=1S/C21H21FN4O2S/c22-16-7-5-15(6-8-16)13-23-19(27)14-29-21-18-4-2-1-3-17(18)20(24-25-21)26-9-11-28-12-10-26/h1-8H,9-14H2,(H,23,27)