cyclohexyl benzenesulfonate; 3-[(4-fluorophenyl)methyl]-1-methyl-1-piperidin-1-yl-urea

Systemtic Name: cyclohexyl benzenesulfonate; 3-[(4-fluorophenyl)methyl]-1-methyl-1-piperidin-1-yl-urea Openeye Name: cyclohexyl benzenesulfonate; 3-[(4-fluorophenyl)methyl]-1-methyl-1-(1-piperidyl)urea CAS Name: benzenesulfonic acid cyclohexyl ester; 3-[(4-fluorophenyl)methyl]-1-methyl-1-(1-piperidinyl)urea IUPAC Name: cyclohexyl benzenesulfonate; 3-[(4-fluorophenyl)methyl]-1-methyl-1-piperidin-1-ylurea Traditional Name: benzenesulfonic acid cyclohexyl ester; 3-(4-fluorobenzyl)-1-methyl-1-piperidino-urea Formula: C26H36FN3O4S MolecularWeight: 505.645143

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Descriptors Computed from Structure

Canonical SMILES:

CN(C(=O)NCC1=CC=C(C=C1)F)N2CCCCC2.C1CCC(CC1)OS(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

CN(C(=O)NCC1=CC=C(C=C1)F)N2CCCCC2.C1CCC(CC1)OS(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C14H20FN3O.C12H16O3S/c1-17(18-9-3-2-4-10-18)14(19)16-11-12-5-7-13(15)8-6-12;13-16(14,12-9-5-2-6-10-12)15-11-7-3-1-4-8-11/h5-8H,2-4,9-11H2,1H3,(H,16,19);2,5-6,9-11H,1,3-4,7-8H2