N-(4-ethylphenyl)-4-fluoranyl-3-(4-methylpiperidin-1-yl)sulfonyl-benzamide

Systemtic Name: N-(4-ethylphenyl)-4-fluoranyl-3-(4-methylpiperidin-1-yl)sulfonyl-benzamide Openeye Name: N-(4-ethylphenyl)-4-fluoro-3-[(4-methyl-1-piperidyl)sulfonyl]benzamide CAS Name: N-(4-ethylphenyl)-4-fluoro-3-[(4-methyl-1-piperidinyl)sulfonyl]benzamide IUPAC Name: N-(4-ethylphenyl)-4-fluoro-3-(4-methylpiperidin-1-yl)sulfonylbenzamide Traditional Name: N-(4-ethylphenyl)-4-fluoro-3-(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=CC(=C(C=C2)F)S(=O)(=O)N3CCC(CC3)C

Isomeric SMILES

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

InChI

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