1-[4-(2,3-dimethylphenyl)piperazin-1-yl]-3-(4-methoxyphenyl)sulfonyl-propan-1-one

Systemtic Name: 1-[4-(2,3-dimethylphenyl)piperazin-1-yl]-3-(4-methoxyphenyl)sulfonyl-propan-1-one Openeye Name: 1-[4-(2,3-dimethylphenyl)piperazin-1-yl]-3-(4-methoxyphenyl)sulfonyl-propan-1-one CAS Name: 1-[4-(2,3-dimethylphenyl)-1-piperazinyl]-3-(4-methoxyphenyl)sulfonyl-1-propanone IUPAC Name: 1-[4-(2,3-dimethylphenyl)piperazin-1-yl]-3-(4-methoxyphenyl)sulfonylpropan-1-one Traditional Name: 1-[4-(2,3-dimethylphenyl)piperazino]-3-(4-methoxyphenyl)sulfonyl-propan-1-one Formula: C22H28N2O4S MolecularWeight: 416.53372

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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