N-[2-[4-(4-butan-2-ylphenyl)sulfonylpiperazin-1-yl]-2-oxidanylidene-ethyl]-2-fluoranyl-benzamide

Systemtic Name: N-[2-[4-(4-butan-2-ylphenyl)sulfonylpiperazin-1-yl]-2-oxidanylidene-ethyl]-2-fluoranyl-benzamide Openeye Name: 2-fluoro-N-[2-oxo-2-[4-(4-sec-butylphenyl)sulfonylpiperazin-1-yl]ethyl]benzamide CAS Name: N-[2-[4-(4-butan-2-ylphenyl)sulfonyl-1-piperazinyl]-2-oxoethyl]-2-fluorobenzamide IUPAC Name: N-[2-[4-(4-butan-2-ylphenyl)sulfonylpiperazin-1-yl]-2-oxoethyl]-2-fluorobenzamide Traditional Name: 2-fluoro-N-[2-keto-2-[4-(4-sec-butylphenyl)sulfonylpiperazino]ethyl]benzamide Formula: C23H28FN3O4S MolecularWeight: 461.549523

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)CNC(=O)C3=CC=CC=C3F

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)CNC(=O)C3=CC=CC=C3F

InChI

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