[4-(5-chloranyl-2-methyl-phenyl)piperazin-1-yl]-[3-(methylsulfonylmethyl)phenyl]methanone

Systemtic Name: [4-(5-chloranyl-2-methyl-phenyl)piperazin-1-yl]-[3-(methylsulfonylmethyl)phenyl]methanone Openeye Name: [4-(5-chloro-2-methyl-phenyl)piperazin-1-yl]-[3-(methylsulfonylmethyl)phenyl]methanone CAS Name: [4-(5-chloro-2-methylphenyl)-1-piperazinyl]-[3-(methylsulfonylmethyl)phenyl]methanone IUPAC Name: [4-(5-chloro-2-methylphenyl)piperazin-1-yl]-[3-(methylsulfonylmethyl)phenyl]methanone Traditional Name: [4-(5-chloro-2-methyl-phenyl)piperazino]-[3-(mesylmethyl)phenyl]methanone Formula: C20H23ClN2O3S MolecularWeight: 406.92622

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H23ClN2O3S/c1-15-6-7-18(21)13-19(15)22-8-10-23(11-9-22)20(24)17-5-3-4-16(12-17)14-27(2,25)26/h3-7,12-13H,8-11,14H2,1-2H3