3-(3-chloranyl-4-methyl-phenyl)-1-[4-(phenylsulfonyl)piperazin-1-yl]propan-1-one

Systemtic Name: 3-(3-chloranyl-4-methyl-phenyl)-1-[4-(phenylsulfonyl)piperazin-1-yl]propan-1-one Openeye Name: 1-[4-(benzenesulfonyl)piperazin-1-yl]-3-(3-chloro-4-methyl-phenyl)propan-1-one CAS Name: 1-[4-(benzenesulfonyl)-1-piperazinyl]-3-(3-chloro-4-methylphenyl)-1-propanone IUPAC Name: 1-[4-(benzenesulfonyl)piperazin-1-yl]-3-(3-chloro-4-methylphenyl)propan-1-one Traditional Name: 1-(4-besylpiperazino)-3-(3-chloro-4-methyl-phenyl)propan-1-one Formula: C20H23ClN2O3S MolecularWeight: 406.92622

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H23ClN2O3S/c1-16-7-8-17(15-19(16)21)9-10-20(24)22-11-13-23(14-12-22)27(25,26)18-5-3-2-4-6-18/h2-8,15H,9-14H2,1H3