1-[(6-ethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-3-(4-fluorophenyl)-1-phenethyl-urea

Systemtic Name: 1-[(6-ethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-3-(4-fluorophenyl)-1-phenethyl-urea Openeye Name: 1-[(6-ethyl-2-oxo-1H-quinolin-3-yl)methyl]-3-(4-fluorophenyl)-1-phenethyl-urea CAS Name: 1-[(6-ethyl-2-oxo-1H-quinolin-3-yl)methyl]-3-(4-fluorophenyl)-1-phenethylurea IUPAC Name: 1-[(6-ethyl-2-oxo-1H-quinolin-3-yl)methyl]-3-(4-fluorophenyl)-1-phenethylurea Traditional Name: 1-[(6-ethyl-2-keto-1H-quinolin-3-yl)methyl]-3-(4-fluorophenyl)-1-phenethyl-urea Formula: C27H26FN3O2 MolecularWeight: 443.512643

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)NC(=O)C(=C2)CN(CCC3=CC=CC=C3)C(=O)NC4=CC=C(C=C4)F

Isomeric SMILES

CCC1=CC2=C(C=C1)NC(=O)C(=C2)CN(CCC3=CC=CC=C3)C(=O)NC4=CC=C(C=C4)F

InChI

InChI=1S/C27H26FN3O2/c1-2-19-8-13-25-21(16-19)17-22(26(32)30-25)18-31(15-14-20-6-4-3-5-7-20)27(33)29-24-11-9-23(28)10-12-24/h3-13,16-17H,2,14-15,18H2,1H3,(H,29,33)(H,30,32)