4-tert-butyl-N-[2-(4-methylsulfonylpiperazin-1-yl)phenyl]benzamide

Systemtic Name: 4-tert-butyl-N-[2-(4-methylsulfonylpiperazin-1-yl)phenyl]benzamide Openeye Name: 4-tert-butyl-N-[2-(4-methylsulfonylpiperazin-1-yl)phenyl]benzamide CAS Name: 4-tert-butyl-N-[2-(4-methylsulfonyl-1-piperazinyl)phenyl]benzamide IUPAC Name: 4-tert-butyl-N-[2-(4-methylsulfonylpiperazin-1-yl)phenyl]benzamide Traditional Name: 4-tert-butyl-N-[2-(4-mesylpiperazino)phenyl]benzamide Formula: C22H29N3O3S MolecularWeight: 415.54896

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)NC2=CC=CC=C2N3CCN(CC3)S(=O)(=O)C

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)NC2=CC=CC=C2N3CCN(CC3)S(=O)(=O)C

InChI

InChI=1S/C22H29N3O3S/c1-22(2,3)18-11-9-17(10-12-18)21(26)23-19-7-5-6-8-20(19)24-13-15-25(16-14-24)29(4,27)28/h5-12H,13-16H2,1-4H3,(H,23,26)