N-(3-fluoranyl-4-methyl-phenyl)-3-(4-phenylpiperazin-1-yl)sulfonyl-benzamide

Systemtic Name: N-(3-fluoranyl-4-methyl-phenyl)-3-(4-phenylpiperazin-1-yl)sulfonyl-benzamide Openeye Name: N-(3-fluoro-4-methyl-phenyl)-3-(4-phenylpiperazin-1-yl)sulfonyl-benzamide CAS Name: N-(3-fluoro-4-methylphenyl)-3-[(4-phenyl-1-piperazinyl)sulfonyl]benzamide IUPAC Name: N-(3-fluoro-4-methylphenyl)-3-(4-phenylpiperazin-1-yl)sulfonylbenzamide Traditional Name: N-(3-fluoro-4-methyl-phenyl)-3-(4-phenylpiperazino)sulfonyl-benzamide Formula: C24H24FN3O3S MolecularWeight: 453.529063

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCN(CC3)C4=CC=CC=C4)F

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCN(CC3)C4=CC=CC=C4)F

InChI

InChI=1S/C24H24FN3O3S/c1-18-10-11-20(17-23(18)25)26-24(29)19-6-5-9-22(16-19)32(30,31)28-14-12-27(13-15-28)21-7-3-2-4-8-21/h2-11,16-17H,12-15H2,1H3,(H,26,29)