N-(3-chloranyl-4-methyl-phenyl)-5-(3,5-dimethylpiperidin-1-yl)sulfonyl-2-fluoranyl-benzamide

Systemtic Name: N-(3-chloranyl-4-methyl-phenyl)-5-(3,5-dimethylpiperidin-1-yl)sulfonyl-2-fluoranyl-benzamide Openeye Name: N-(3-chloro-4-methyl-phenyl)-5-[(3,5-dimethyl-1-piperidyl)sulfonyl]-2-fluoro-benzamide CAS Name: N-(3-chloro-4-methylphenyl)-5-[(3,5-dimethyl-1-piperidinyl)sulfonyl]-2-fluorobenzamide IUPAC Name: N-(3-chloro-4-methylphenyl)-5-(3,5-dimethylpiperidin-1-yl)sulfonyl-2-fluorobenzamide Traditional Name: N-(3-chloro-4-methyl-phenyl)-5-(3,5-dimethylpiperidino)sulfonyl-2-fluoro-benzamide Formula: C21H24ClFN2O3S MolecularWeight: 438.943263

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)S(=O)(=O)C2=CC(=C(C=C2)F)C(=O)NC3=CC(=C(C=C3)C)Cl)C

Isomeric SMILES

CC1CC(CN(C1)S(=O)(=O)C2=CC(=C(C=C2)F)C(=O)NC3=CC(=C(C=C3)C)Cl)C

InChI

InChI=1S/C21H24ClFN2O3S/c1-13-8-14(2)12-25(11-13)29(27,28)17-6-7-20(23)18(10-17)21(26)24-16-5-4-15(3)19(22)9-16/h4-7,9-10,13-14H,8,11-12H2,1-3H3,(H,24,26)