1-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]-2-(3-methoxyphenyl)ethanone

Systemtic Name: 1-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]-2-(3-methoxyphenyl)ethanone Openeye Name: 1-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]-2-(3-methoxyphenyl)ethanone CAS Name: 1-[4-(2,5-dimethylphenyl)sulfonyl-1-piperazinyl]-2-(3-methoxyphenyl)ethanone IUPAC Name: 1-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]-2-(3-methoxyphenyl)ethanone Traditional Name: 1-[4-(2,5-dimethylphenyl)sulfonylpiperazino]-2-(3-methoxyphenyl)ethanone Formula: C21H26N2O4S MolecularWeight: 402.50714

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)S(=O)(=O)N2CCN(CC2)C(=O)CC3=CC(=CC=C3)OC

Isomeric SMILES

CC1=CC(=C(C=C1)C)S(=O)(=O)N2CCN(CC2)C(=O)CC3=CC(=CC=C3)OC

InChI

InChI=1S/C21H26N2O4S/c1-16-7-8-17(2)20(13-16)28(25,26)23-11-9-22(10-12-23)21(24)15-18-5-4-6-19(14-18)27-3/h4-8,13-14H,9-12,15H2,1-3H3