N-(1-cyanocycloheptyl)-2-[4-(4-fluorophenyl)sulfonylpiperazin-1-yl]ethanamide

Systemtic Name: N-(1-cyanocycloheptyl)-2-[4-(4-fluorophenyl)sulfonylpiperazin-1-yl]ethanamide Openeye Name: N-(1-cyanocycloheptyl)-2-[4-(4-fluorophenyl)sulfonylpiperazin-1-yl]acetamide CAS Name: N-(1-cyanocycloheptyl)-2-[4-(4-fluorophenyl)sulfonyl-1-piperazinyl]acetamide IUPAC Name: N-(1-cyanocycloheptyl)-2-[4-(4-fluorophenyl)sulfonylpiperazin-1-yl]acetamide Traditional Name: N-(1-cyanocycloheptyl)-2-[4-(4-fluorophenyl)sulfonylpiperazino]acetamide Formula: C20H27FN4O3S MolecularWeight: 422.516783

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)(C#N)NC(=O)CN2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)F

Isomeric SMILES

C1CCCC(CC1)(C#N)NC(=O)CN2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C20H27FN4O3S/c21-17-5-7-18(8-6-17)29(27,28)25-13-11-24(12-14-25)15-19(26)23-20(16-22)9-3-1-2-4-10-20/h5-8H,1-4,9-15H2,(H,23,26)