1-[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]-3-(4-methylphenoxy)propan-1-one

Systemtic Name: 1-[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]-3-(4-methylphenoxy)propan-1-one Openeye Name: 1-[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]-3-(4-methylphenoxy)propan-1-one CAS Name: 1-[4-(3,4-dimethylphenyl)sulfonyl-1-piperazinyl]-3-(4-methylphenoxy)-1-propanone IUPAC Name: 1-[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]-3-(4-methylphenoxy)propan-1-one Traditional Name: 1-[4-(3,4-dimethylphenyl)sulfonylpiperazino]-3-(4-methylphenoxy)propan-1-one Formula: C22H28N2O4S MolecularWeight: 416.53372

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H28N2O4S/c1-17-4-7-20(8-5-17)28-15-10-22(25)23-11-13-24(14-12-23)29(26,27)21-9-6-18(2)19(3)16-21/h4-9,16H,10-15H2,1-3H3