1-cyclohexyl-3-[(2S)-2-(4-fluoranyl-3-methyl-phenyl)sulfonyl-2-pyridin-3-yl-ethyl]urea

Systemtic Name: 1-cyclohexyl-3-[(2S)-2-(4-fluoranyl-3-methyl-phenyl)sulfonyl-2-pyridin-3-yl-ethyl]urea Openeye Name: 1-cyclohexyl-3-[(2S)-2-(4-fluoro-3-methyl-phenyl)sulfonyl-2-(3-pyridyl)ethyl]urea CAS Name: 1-cyclohexyl-3-[(2S)-2-(4-fluoro-3-methylphenyl)sulfonyl-2-(3-pyridinyl)ethyl]urea IUPAC Name: 1-cyclohexyl-3-[(2S)-2-(4-fluoro-3-methylphenyl)sulfonyl-2-pyridin-3-ylethyl]urea Traditional Name: 1-cyclohexyl-3-[(2S)-2-(4-fluoro-3-methyl-phenyl)sulfonyl-2-(3-pyridyl)ethyl]urea Formula: C21H26FN3O3S MolecularWeight: 419.512843

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)S(=O)(=O)C(CNC(=O)NC2CCCCC2)C3=CN=CC=C3)F

Isomeric SMILES

CC1=C(C=CC(=C1)S(=O)(=O)[C@H](CNC(=O)NC2CCCCC2)C3=CN=CC=C3)F

InChI

InChI=1S/C21H26FN3O3S/c1-15-12-18(9-10-19(15)22)29(27,28)20(16-6-5-11-23-13-16)14-24-21(26)25-17-7-3-2-4-8-17/h5-6,9-13,17,20H,2-4,7-8,14H2,1H3,(H2,24,25,26)/t20-/m1/s1