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

Systemtic Name: N-(4-ethylphenyl)-4-fluoranyl-3-(3-methylpiperidin-1-yl)sulfonyl-benzamide Openeye Name: N-(4-ethylphenyl)-4-fluoro-3-[(3-methyl-1-piperidyl)sulfonyl]benzamide CAS Name: N-(4-ethylphenyl)-4-fluoro-3-[(3-methyl-1-piperidinyl)sulfonyl]benzamide IUPAC Name: N-(4-ethylphenyl)-4-fluoro-3-(3-methylpiperidin-1-yl)sulfonylbenzamide Traditional Name: N-(4-ethylphenyl)-4-fluoro-3-(3-methylpiperidino)sulfonyl-benzamide Formula: C21H25FN2O3S MolecularWeight: 404.498203

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=O)C2=CC(=C(C=C2)F)S(=O)(=O)N3CCCC(C3)C

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=O)C2=CC(=C(C=C2)F)S(=O)(=O)N3CCCC(C3)C

InChI

InChI=1S/C21H25FN2O3S/c1-3-16-6-9-18(10-7-16)23-21(25)17-8-11-19(22)20(13-17)28(26,27)24-12-4-5-15(2)14-24/h6-11,13,15H,3-5,12,14H2,1-2H3,(H,23,25)