N-(1-cyanocycloheptyl)-2-[4-(2,4,6-trimethylphenyl)sulfonylpiperazin-1-yl]ethanamide

Systemtic Name: N-(1-cyanocycloheptyl)-2-[4-(2,4,6-trimethylphenyl)sulfonylpiperazin-1-yl]ethanamide Openeye Name: N-(1-cyanocycloheptyl)-2-[4-(2,4,6-trimethylphenyl)sulfonylpiperazin-1-yl]acetamide CAS Name: N-(1-cyanocycloheptyl)-2-[4-(2,4,6-trimethylphenyl)sulfonyl-1-piperazinyl]acetamide IUPAC Name: N-(1-cyanocycloheptyl)-2-[4-(2,4,6-trimethylphenyl)sulfonylpiperazin-1-yl]acetamide Traditional Name: N-(1-cyanocycloheptyl)-2-(4-mesitylsulfonylpiperazino)acetamide Formula: C23H34N4O3S MolecularWeight: 446.60606

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)S(=O)(=O)N2CCN(CC2)CC(=O)NC3(CCCCCC3)C#N)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)S(=O)(=O)N2CCN(CC2)CC(=O)NC3(CCCCCC3)C#N)C

InChI

InChI=1S/C23H34N4O3S/c1-18-14-19(2)22(20(3)15-18)31(29,30)27-12-10-26(11-13-27)16-21(28)25-23(17-24)8-6-4-5-7-9-23/h14-15H,4-13,16H2,1-3H3,(H,25,28)