N-(1-cyanocyclopentyl)-2-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]ethanamide

Systemtic Name: N-(1-cyanocyclopentyl)-2-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]ethanamide Openeye Name: N-(1-cyanocyclopentyl)-2-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]acetamide CAS Name: N-(1-cyanocyclopentyl)-2-[4-(2,5-dimethylphenyl)sulfonyl-1-piperazinyl]acetamide IUPAC Name: N-(1-cyanocyclopentyl)-2-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]acetamide Traditional Name: N-(1-cyanocyclopentyl)-2-[4-(2,5-dimethylphenyl)sulfonylpiperazino]acetamide Formula: C20H28N4O3S MolecularWeight: 404.52632

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)S(=O)(=O)N2CCN(CC2)CC(=O)NC3(CCCC3)C#N

Isomeric SMILES

CC1=CC(=C(C=C1)C)S(=O)(=O)N2CCN(CC2)CC(=O)NC3(CCCC3)C#N

InChI

InChI=1S/C20H28N4O3S/c1-16-5-6-17(2)18(13-16)28(26,27)24-11-9-23(10-12-24)14-19(25)22-20(15-21)7-3-4-8-20/h5-6,13H,3-4,7-12,14H2,1-2H3,(H,22,25)