[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]-(3-ethoxy-4-propoxy-phenyl)methanone

Systemtic Name: [4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]-(3-ethoxy-4-propoxy-phenyl)methanone Openeye Name: [4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]-(3-ethoxy-4-propoxy-phenyl)methanone CAS Name: [4-(2,5-dimethylphenyl)sulfonyl-1-piperazinyl]-(3-ethoxy-4-propoxyphenyl)methanone IUPAC Name: [4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]-(3-ethoxy-4-propoxyphenyl)methanone Traditional Name: [4-(2,5-dimethylphenyl)sulfonylpiperazino]-(3-ethoxy-4-propoxy-phenyl)methanone Formula: C24H32N2O5S MolecularWeight: 460.58628

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)C(=O)N2CCN(CC2)S(=O)(=O)C3=C(C=CC(=C3)C)C)OCC

Isomeric SMILES

CCCOC1=C(C=C(C=C1)C(=O)N2CCN(CC2)S(=O)(=O)C3=C(C=CC(=C3)C)C)OCC

InChI

InChI=1S/C24H32N2O5S/c1-5-15-31-21-10-9-20(17-22(21)30-6-2)24(27)25-11-13-26(14-12-25)32(28,29)23-16-18(3)7-8-19(23)4/h7-10,16-17H,5-6,11-15H2,1-4H3