2-[[1-[bis(fluoranyl)methyl]benzimidazol-2-yl]methylsulfanyl]-3-propan-2-yl-quinazolin-4-one

Systemtic Name: 2-[[1-[bis(fluoranyl)methyl]benzimidazol-2-yl]methylsulfanyl]-3-propan-2-yl-quinazolin-4-one Openeye Name: 2-[[1-(difluoromethyl)benzimidazol-2-yl]methylsulfanyl]-3-isopropyl-quinazolin-4-one CAS Name: 2-[[1-(difluoromethyl)-2-benzimidazolyl]methylthio]-3-propan-2-yl-4-quinazolinone IUPAC Name: 2-[[1-(difluoromethyl)benzimidazol-2-yl]methylsulfanyl]-3-propan-2-ylquinazolin-4-one Traditional Name: 2-[[1-(difluoromethyl)benzimidazol-2-yl]methylthio]-3-isopropyl-quinazolin-4-one Formula: C20H18F2N4OS MolecularWeight: 400.444926

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C(=O)C2=CC=CC=C2N=C1SCC3=NC4=CC=CC=C4N3C(F)F

Isomeric SMILES

CC(C)N1C(=O)C2=CC=CC=C2N=C1SCC3=NC4=CC=CC=C4N3C(F)F

InChI

InChI=1S/C20H18F2N4OS/c1-12(2)25-18(27)13-7-3-4-8-14(13)24-20(25)28-11-17-23-15-9-5-6-10-16(15)26(17)19(21)22/h3-10,12,19H,11H2,1-2H3