3-(2,6-dimethylphenyl)-1-[(3-fluoranylpyridin-2-yl)methyl]-1-(4-phenylcyclohexyl)urea

Systemtic Name: 3-(2,6-dimethylphenyl)-1-[(3-fluoranylpyridin-2-yl)methyl]-1-(4-phenylcyclohexyl)urea Openeye Name: 3-(2,6-dimethylphenyl)-1-[(3-fluoro-2-pyridyl)methyl]-1-(4-phenylcyclohexyl)urea CAS Name: 3-(2,6-dimethylphenyl)-1-[(3-fluoro-2-pyridinyl)methyl]-1-(4-phenylcyclohexyl)urea IUPAC Name: 3-(2,6-dimethylphenyl)-1-[(3-fluoropyridin-2-yl)methyl]-1-(4-phenylcyclohexyl)urea Traditional Name: 3-(2,6-dimethylphenyl)-1-[(3-fluoro-2-pyridyl)methyl]-1-(4-phenylcyclohexyl)urea Formula: C27H30FN3O MolecularWeight: 431.545003

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=O)N(CC2=C(C=CC=N2)F)C3CCC(CC3)C4=CC=CC=C4

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=O)N(CC2=C(C=CC=N2)F)C3CCC(CC3)C4=CC=CC=C4

InChI

InChI=1S/C27H30FN3O/c1-19-8-6-9-20(2)26(19)30-27(32)31(18-25-24(28)12-7-17-29-25)23-15-13-22(14-16-23)21-10-4-3-5-11-21/h3-12,17,22-23H,13-16,18H2,1-2H3,(H,30,32)