1-[4-(4-tert-butyl-2,6-dimethyl-phenyl)sulfonylpiperazin-1-yl]-2,2-dimethyl-propan-1-one

Systemtic Name: 1-[4-(4-tert-butyl-2,6-dimethyl-phenyl)sulfonylpiperazin-1-yl]-2,2-dimethyl-propan-1-one Openeye Name: 1-[4-(4-tert-butyl-2,6-dimethyl-phenyl)sulfonylpiperazin-1-yl]-2,2-dimethyl-propan-1-one CAS Name: 1-[4-(4-tert-butyl-2,6-dimethylphenyl)sulfonyl-1-piperazinyl]-2,2-dimethyl-1-propanone IUPAC Name: 1-[4-(4-tert-butyl-2,6-dimethylphenyl)sulfonylpiperazin-1-yl]-2,2-dimethylpropan-1-one Traditional Name: 1-[4-(4-tert-butyl-2,6-dimethyl-phenyl)sulfonylpiperazino]-2,2-dimethyl-propan-1-one Formula: C21H34N2O3S MolecularWeight: 394.57126

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1S(=O)(=O)N2CCN(CC2)C(=O)C(C)(C)C)C)C(C)(C)C

Isomeric SMILES

CC1=CC(=CC(=C1S(=O)(=O)N2CCN(CC2)C(=O)C(C)(C)C)C)C(C)(C)C

InChI

InChI=1S/C21H34N2O3S/c1-15-13-17(20(3,4)5)14-16(2)18(15)27(25,26)23-11-9-22(10-12-23)19(24)21(6,7)8/h13-14H,9-12H2,1-8H3