N-(4-ethylphenyl)-2-fluoranyl-5-(4-methylpiperidin-1-yl)sulfonyl-benzamide

Systemtic Name: N-(4-ethylphenyl)-2-fluoranyl-5-(4-methylpiperidin-1-yl)sulfonyl-benzamide Openeye Name: N-(4-ethylphenyl)-2-fluoro-5-[(4-methyl-1-piperidyl)sulfonyl]benzamide CAS Name: N-(4-ethylphenyl)-2-fluoro-5-[(4-methyl-1-piperidinyl)sulfonyl]benzamide IUPAC Name: N-(4-ethylphenyl)-2-fluoro-5-(4-methylpiperidin-1-yl)sulfonylbenzamide Traditional Name: N-(4-ethylphenyl)-2-fluoro-5-(4-methylpiperidino)sulfonyl-benzamide Formula: C21H25FN2O3S MolecularWeight: 404.498203

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCC(CC3)C)F

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCC(CC3)C)F

InChI

InChI=1S/C21H25FN2O3S/c1-3-16-4-6-17(7-5-16)23-21(25)19-14-18(8-9-20(19)22)28(26,27)24-12-10-15(2)11-13-24/h4-9,14-15H,3,10-13H2,1-2H3,(H,23,25)