3-(2-chloranyl-6-methyl-pyridin-3-yl)-1-cycloheptyl-1-[[4-(4-fluoranylphenoxy)phenyl]methyl]urea

Systemtic Name: 3-(2-chloranyl-6-methyl-pyridin-3-yl)-1-cycloheptyl-1-[[4-(4-fluoranylphenoxy)phenyl]methyl]urea Openeye Name: 3-(2-chloro-6-methyl-3-pyridyl)-1-cycloheptyl-1-[[4-(4-fluorophenoxy)phenyl]methyl]urea CAS Name: 3-(2-chloro-6-methyl-3-pyridinyl)-1-cycloheptyl-1-[[4-(4-fluorophenoxy)phenyl]methyl]urea IUPAC Name: 3-(2-chloro-6-methylpyridin-3-yl)-1-cycloheptyl-1-[[4-(4-fluorophenoxy)phenyl]methyl]urea Traditional Name: 3-(2-chloro-6-methyl-3-pyridyl)-1-cycloheptyl-1-[4-(4-fluorophenoxy)benzyl]urea Formula: C27H29ClFN3O2 MolecularWeight: 481.989463

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C=C1)NC(=O)N(CC2=CC=C(C=C2)OC3=CC=C(C=C3)F)C4CCCCCC4)Cl

Isomeric SMILES

CC1=NC(=C(C=C1)NC(=O)N(CC2=CC=C(C=C2)OC3=CC=C(C=C3)F)C4CCCCCC4)Cl

InChI

InChI=1S/C27H29ClFN3O2/c1-19-8-17-25(26(28)30-19)31-27(33)32(22-6-4-2-3-5-7-22)18-20-9-13-23(14-10-20)34-24-15-11-21(29)12-16-24/h8-17,22H,2-7,18H2,1H3,(H,31,33)