(3-chloranyl-4,5-dimethoxy-phenyl)-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]methanone

Systemtic Name: (3-chloranyl-4,5-dimethoxy-phenyl)-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]methanone Openeye Name: (3-chloro-4,5-dimethoxy-phenyl)-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]methanone CAS Name: (3-chloro-4,5-dimethoxyphenyl)-[4-(2,4-dimethylphenyl)sulfonyl-1-piperazinyl]methanone IUPAC Name: (3-chloro-4,5-dimethoxyphenyl)-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]methanone Traditional Name: (3-chloro-4,5-dimethoxy-phenyl)-[4-(2,4-dimethylphenyl)sulfonylpiperazino]methanone Formula: C21H25ClN2O5S MolecularWeight: 452.9516

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H25ClN2O5S/c1-14-5-6-19(15(2)11-14)30(26,27)24-9-7-23(8-10-24)21(25)16-12-17(22)20(29-4)18(13-16)28-3/h5-6,11-13H,7-10H2,1-4H3