3-(4-chlorophenyl)sulfonyl-1-[4-(2,5-dimethylphenyl)piperazin-1-yl]propan-1-one

Systemtic Name: 3-(4-chlorophenyl)sulfonyl-1-[4-(2,5-dimethylphenyl)piperazin-1-yl]propan-1-one Openeye Name: 3-(4-chlorophenyl)sulfonyl-1-[4-(2,5-dimethylphenyl)piperazin-1-yl]propan-1-one CAS Name: 3-(4-chlorophenyl)sulfonyl-1-[4-(2,5-dimethylphenyl)-1-piperazinyl]-1-propanone IUPAC Name: 3-(4-chlorophenyl)sulfonyl-1-[4-(2,5-dimethylphenyl)piperazin-1-yl]propan-1-one Traditional Name: 3-(4-chlorophenyl)sulfonyl-1-[4-(2,5-dimethylphenyl)piperazino]propan-1-one Formula: C21H25ClN2O3S MolecularWeight: 420.9528

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)N2CCN(CC2)C(=O)CCS(=O)(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC1=CC(=C(C=C1)C)N2CCN(CC2)C(=O)CCS(=O)(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C21H25ClN2O3S/c1-16-3-4-17(2)20(15-16)23-10-12-24(13-11-23)21(25)9-14-28(26,27)19-7-5-18(22)6-8-19/h3-8,15H,9-14H2,1-2H3