1-[2-[1-(4-fluoranyl-2-methyl-phenyl)sulfonylpiperidin-2-yl]ethyl]-3-phenyl-urea

Systemtic Name: 1-[2-[1-(4-fluoranyl-2-methyl-phenyl)sulfonylpiperidin-2-yl]ethyl]-3-phenyl-urea Openeye Name: 1-[2-[1-(4-fluoro-2-methyl-phenyl)sulfonyl-2-piperidyl]ethyl]-3-phenyl-urea CAS Name: 1-[2-[1-(4-fluoro-2-methylphenyl)sulfonyl-2-piperidinyl]ethyl]-3-phenylurea IUPAC Name: 1-[2-[1-(4-fluoro-2-methylphenyl)sulfonylpiperidin-2-yl]ethyl]-3-phenylurea Traditional Name: 1-[2-[1-(4-fluoro-2-methyl-phenyl)sulfonyl-2-piperidyl]ethyl]-3-phenyl-urea Formula: C21H26FN3O3S MolecularWeight: 419.512843

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)F)S(=O)(=O)N2CCCCC2CCNC(=O)NC3=CC=CC=C3

Isomeric SMILES

CC1=C(C=CC(=C1)F)S(=O)(=O)N2CCCCC2CCNC(=O)NC3=CC=CC=C3

InChI

InChI=1S/C21H26FN3O3S/c1-16-15-17(22)10-11-20(16)29(27,28)25-14-6-5-9-19(25)12-13-23-21(26)24-18-7-3-2-4-8-18/h2-4,7-8,10-11,15,19H,5-6,9,12-14H2,1H3,(H2,23,24,26)