4-fluoranyl-N-[3-methyl-1-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-1-oxidanylidene-butan-2-yl]benzamide

Systemtic Name: 4-fluoranyl-N-[3-methyl-1-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-1-oxidanylidene-butan-2-yl]benzamide Openeye Name: 4-fluoro-N-[2-methyl-1-[4-(p-tolylsulfonyl)piperazine-1-carbonyl]propyl]benzamide CAS Name: 4-fluoro-N-[3-methyl-1-[4-(4-methylphenyl)sulfonyl-1-piperazinyl]-1-oxobutan-2-yl]benzamide IUPAC Name: 4-fluoro-N-[3-methyl-1-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-1-oxobutan-2-yl]benzamide Traditional Name: 4-fluoro-N-[2-methyl-1-(4-tosylpiperazine-1-carbonyl)propyl]benzamide Formula: C23H28FN3O4S MolecularWeight: 461.549523

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C(C(C)C)NC(=O)C3=CC=C(C=C3)F

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C(C(C)C)NC(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C23H28FN3O4S/c1-16(2)21(25-22(28)18-6-8-19(24)9-7-18)23(29)26-12-14-27(15-13-26)32(30,31)20-10-4-17(3)5-11-20/h4-11,16,21H,12-15H2,1-3H3,(H,25,28)