2-[2-(dimethylaminomethyl)quinazolin-4-yl]sulfanyl-N-[(4-fluorophenyl)methyl]ethanamide

Systemtic Name: 2-[2-(dimethylaminomethyl)quinazolin-4-yl]sulfanyl-N-[(4-fluorophenyl)methyl]ethanamide Openeye Name: 2-[2-(dimethylaminomethyl)quinazolin-4-yl]sulfanyl-N-[(4-fluorophenyl)methyl]acetamide CAS Name: 2-[[2-(dimethylaminomethyl)-4-quinazolinyl]thio]-N-[(4-fluorophenyl)methyl]acetamide IUPAC Name: 2-[2-(dimethylaminomethyl)quinazolin-4-yl]sulfanyl-N-[(4-fluorophenyl)methyl]acetamide Traditional Name: 2-[[2-(dimethylaminomethyl)quinazolin-4-yl]thio]-N-(4-fluorobenzyl)acetamide Formula: C20H21FN4OS MolecularWeight: 384.470343

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC1=NC2=CC=CC=C2C(=N1)SCC(=O)NCC3=CC=C(C=C3)F

Isomeric SMILES

CN(C)CC1=NC2=CC=CC=C2C(=N1)SCC(=O)NCC3=CC=C(C=C3)F

InChI

InChI=1S/C20H21FN4OS/c1-25(2)12-18-23-17-6-4-3-5-16(17)20(24-18)27-13-19(26)22-11-14-7-9-15(21)10-8-14/h3-10H,11-13H2,1-2H3,(H,22,26)