1-[[2,4-bis(fluoranyl)phenyl]methyl]-3-(4-ethylphenyl)-1-[[3-(2-methoxyphenyl)-4,5-dihydro-1,2-oxazol-5-yl]methyl]urea

Systemtic Name: 1-[[2,4-bis(fluoranyl)phenyl]methyl]-3-(4-ethylphenyl)-1-[[3-(2-methoxyphenyl)-4,5-dihydro-1,2-oxazol-5-yl]methyl]urea Openeye Name: 1-[(2,4-difluorophenyl)methyl]-3-(4-ethylphenyl)-1-[[3-(2-methoxyphenyl)-4,5-dihydroisoxazol-5-yl]methyl]urea CAS Name: 1-[(2,4-difluorophenyl)methyl]-3-(4-ethylphenyl)-1-[[3-(2-methoxyphenyl)-4,5-dihydroisoxazol-5-yl]methyl]urea IUPAC Name: 1-[(2,4-difluorophenyl)methyl]-3-(4-ethylphenyl)-1-[[3-(2-methoxyphenyl)-4,5-dihydro-1,2-oxazol-5-yl]methyl]urea Traditional Name: 1-(2,4-difluorobenzyl)-3-(4-ethylphenyl)-1-[[3-(2-methoxyphenyl)-2-isoxazolin-5-yl]methyl]urea Formula: C27H27F2N3O3 MolecularWeight: 479.518386

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=O)N(CC2CC(=NO2)C3=CC=CC=C3OC)CC4=C(C=C(C=C4)F)F

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=O)N(CC2CC(=NO2)C3=CC=CC=C3OC)CC4=C(C=C(C=C4)F)F

InChI

InChI=1S/C27H27F2N3O3/c1-3-18-8-12-21(13-9-18)30-27(33)32(16-19-10-11-20(28)14-24(19)29)17-22-15-25(31-35-22)23-6-4-5-7-26(23)34-2/h4-14,22H,3,15-17H2,1-2H3,(H,30,33)