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

Systemtic Name: N-(4-ethylphenyl)-4-fluoranyl-3-(4-methylpiperazin-1-yl)sulfonyl-benzamide Openeye Name: N-(4-ethylphenyl)-4-fluoro-3-(4-methylpiperazin-1-yl)sulfonyl-benzamide CAS Name: N-(4-ethylphenyl)-4-fluoro-3-[(4-methyl-1-piperazinyl)sulfonyl]benzamide IUPAC Name: N-(4-ethylphenyl)-4-fluoro-3-(4-methylpiperazin-1-yl)sulfonylbenzamide Traditional Name: N-(4-ethylphenyl)-4-fluoro-3-(4-methylpiperazino)sulfonyl-benzamide Formula: C20H24FN3O3S MolecularWeight: 405.486263

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)N3CCN(CC3)C

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=O)C2=CC(=C(C=C2)F)S(=O)(=O)N3CCN(CC3)C

InChI

InChI=1S/C20H24FN3O3S/c1-3-15-4-7-17(8-5-15)22-20(25)16-6-9-18(21)19(14-16)28(26,27)24-12-10-23(2)11-13-24/h4-9,14H,3,10-13H2,1-2H3,(H,22,25)