N-(2-ethyl-6-methyl-phenyl)-4-fluoranyl-3-piperidin-1-ylsulfonyl-benzamide

Systemtic Name: N-(2-ethyl-6-methyl-phenyl)-4-fluoranyl-3-piperidin-1-ylsulfonyl-benzamide Openeye Name: N-(2-ethyl-6-methyl-phenyl)-4-fluoro-3-(1-piperidylsulfonyl)benzamide CAS Name: N-(2-ethyl-6-methylphenyl)-4-fluoro-3-(1-piperidinylsulfonyl)benzamide IUPAC Name: N-(2-ethyl-6-methylphenyl)-4-fluoro-3-piperidin-1-ylsulfonylbenzamide Traditional Name: N-(2-ethyl-6-methyl-phenyl)-4-fluoro-3-piperidinosulfonyl-benzamide Formula: C21H25FN2O3S MolecularWeight: 404.498203

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1NC(=O)C2=CC(=C(C=C2)F)S(=O)(=O)N3CCCCC3)C

Isomeric SMILES

CCC1=CC=CC(=C1NC(=O)C2=CC(=C(C=C2)F)S(=O)(=O)N3CCCCC3)C

InChI

InChI=1S/C21H25FN2O3S/c1-3-16-9-7-8-15(2)20(16)23-21(25)17-10-11-18(22)19(14-17)28(26,27)24-12-5-4-6-13-24/h7-11,14H,3-6,12-13H2,1-2H3,(H,23,25)