[5-[(4-chloranyl-3,5-dimethyl-phenoxy)methyl]furan-2-yl]-(4-ethylsulfonylpiperazin-1-yl)methanone

Systemtic Name: [5-[(4-chloranyl-3,5-dimethyl-phenoxy)methyl]furan-2-yl]-(4-ethylsulfonylpiperazin-1-yl)methanone Openeye Name: [5-[(4-chloro-3,5-dimethyl-phenoxy)methyl]-2-furyl]-(4-ethylsulfonylpiperazin-1-yl)methanone CAS Name: [5-[(4-chloro-3,5-dimethylphenoxy)methyl]-2-furanyl]-(4-ethylsulfonyl-1-piperazinyl)methanone IUPAC Name: [5-[(4-chloro-3,5-dimethylphenoxy)methyl]furan-2-yl]-(4-ethylsulfonylpiperazin-1-yl)methanone Traditional Name: [5-[(4-chloro-3,5-dimethyl-phenoxy)methyl]-2-furyl]-(4-esylpiperazino)methanone Formula: C20H25ClN2O5S MolecularWeight: 440.9409

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)N1CCN(CC1)C(=O)C2=CC=C(O2)COC3=CC(=C(C(=C3)C)Cl)C

Isomeric SMILES

CCS(=O)(=O)N1CCN(CC1)C(=O)C2=CC=C(O2)COC3=CC(=C(C(=C3)C)Cl)C

InChI

InChI=1S/C20H25ClN2O5S/c1-4-29(25,26)23-9-7-22(8-10-23)20(24)18-6-5-16(28-18)13-27-17-11-14(2)19(21)15(3)12-17/h5-6,11-12H,4,7-10,13H2,1-3H3