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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H23ClN2O3S/c1-14-5-7-17(27(3,25)26)13-18(14)20(24)23-10-8-22(9-11-23)19-12-16(21)6-4-15(19)2/h4-7,12-13H,8-11H2,1-3H3