1-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]-3-(4-ethylphenyl)propan-1-one

Systemtic Name: 1-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]-3-(4-ethylphenyl)propan-1-one Openeye Name: 1-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]-3-(4-ethylphenyl)propan-1-one CAS Name: 1-[4-(2,4-dimethylphenyl)sulfonyl-1-piperazinyl]-3-(4-ethylphenyl)-1-propanone IUPAC Name: 1-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]-3-(4-ethylphenyl)propan-1-one Traditional Name: 1-[4-(2,4-dimethylphenyl)sulfonylpiperazino]-3-(4-ethylphenyl)propan-1-one Formula: C23H30N2O3S MolecularWeight: 414.5609

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)CCC(=O)N2CCN(CC2)S(=O)(=O)C3=C(C=C(C=C3)C)C

Isomeric SMILES

CCC1=CC=C(C=C1)CCC(=O)N2CCN(CC2)S(=O)(=O)C3=C(C=C(C=C3)C)C

InChI

InChI=1S/C23H30N2O3S/c1-4-20-6-8-21(9-7-20)10-12-23(26)24-13-15-25(16-14-24)29(27,28)22-11-5-18(2)17-19(22)3/h5-9,11,17H,4,10,12-16H2,1-3H3