3-[2,4-bis(fluoranyl)phenyl]-1-[(4-cyclopentylphenyl)methyl]-1-heptyl-urea

Systemtic Name: 3-[2,4-bis(fluoranyl)phenyl]-1-[(4-cyclopentylphenyl)methyl]-1-heptyl-urea Openeye Name: 1-[(4-cyclopentylphenyl)methyl]-3-(2,4-difluorophenyl)-1-heptyl-urea CAS Name: 1-[(4-cyclopentylphenyl)methyl]-3-(2,4-difluorophenyl)-1-heptylurea IUPAC Name: 1-[(4-cyclopentylphenyl)methyl]-3-(2,4-difluorophenyl)-1-heptylurea Traditional Name: 1-(4-cyclopentylbenzyl)-3-(2,4-difluorophenyl)-1-heptyl-urea Formula: C26H34F2N2O MolecularWeight: 428.557766

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCN(CC1=CC=C(C=C1)C2CCCC2)C(=O)NC3=C(C=C(C=C3)F)F

Isomeric SMILES

CCCCCCCN(CC1=CC=C(C=C1)C2CCCC2)C(=O)NC3=C(C=C(C=C3)F)F

InChI

InChI=1S/C26H34F2N2O/c1-2-3-4-5-8-17-30(26(31)29-25-16-15-23(27)18-24(25)28)19-20-11-13-22(14-12-20)21-9-6-7-10-21/h11-16,18,21H,2-10,17,19H2,1H3,(H,29,31)