N-(2,3-dimethylcyclohexyl)-2-[4-(4-fluorophenyl)sulfonylpiperazin-1-yl]ethanamide

Systemtic Name: N-(2,3-dimethylcyclohexyl)-2-[4-(4-fluorophenyl)sulfonylpiperazin-1-yl]ethanamide Openeye Name: N-(2,3-dimethylcyclohexyl)-2-[4-(4-fluorophenyl)sulfonylpiperazin-1-yl]acetamide CAS Name: N-(2,3-dimethylcyclohexyl)-2-[4-(4-fluorophenyl)sulfonyl-1-piperazinyl]acetamide IUPAC Name: N-(2,3-dimethylcyclohexyl)-2-[4-(4-fluorophenyl)sulfonylpiperazin-1-yl]acetamide Traditional Name: N-(2,3-dimethylcyclohexyl)-2-[4-(4-fluorophenyl)sulfonylpiperazino]acetamide Formula: C20H30FN3O3S MolecularWeight: 411.533903

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(C1C)NC(=O)CN2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)F

Isomeric SMILES

CC1CCCC(C1C)NC(=O)CN2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C20H30FN3O3S/c1-15-4-3-5-19(16(15)2)22-20(25)14-23-10-12-24(13-11-23)28(26,27)18-8-6-17(21)7-9-18/h6-9,15-16,19H,3-5,10-14H2,1-2H3,(H,22,25)