N-cyclooctyl-1-(3-ethanoylphenyl)-2-methyl-4-methylsulfonyl-6-oxidanylidene-piperazine-2-carboxamide

Systemtic Name: N-cyclooctyl-1-(3-ethanoylphenyl)-2-methyl-4-methylsulfonyl-6-oxidanylidene-piperazine-2-carboxamide Openeye Name: 1-(3-acetylphenyl)-N-cyclooctyl-2-methyl-4-methylsulfonyl-6-oxo-piperazine-2-carboxamide CAS Name: 1-(3-acetylphenyl)-N-cyclooctyl-2-methyl-4-methylsulfonyl-6-oxo-2-piperazinecarboxamide IUPAC Name: 1-(3-acetylphenyl)-N-cyclooctyl-2-methyl-4-methylsulfonyl-6-oxopiperazine-2-carboxamide Traditional Name: 1-(3-acetylphenyl)-N-cyclooctyl-6-keto-4-mesyl-2-methyl-piperazine-2-carboxamide Formula: C23H33N3O5S MolecularWeight: 463.59022

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)N2C(=O)CN(CC2(C)C(=O)NC3CCCCCCC3)S(=O)(=O)C

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)N2C(=O)CN(CC2(C)C(=O)NC3CCCCCCC3)S(=O)(=O)C

InChI

InChI=1S/C23H33N3O5S/c1-17(27)18-10-9-13-20(14-18)26-21(28)15-25(32(3,30)31)16-23(26,2)22(29)24-19-11-7-5-4-6-8-12-19/h9-10,13-14,19H,4-8,11-12,15-16H2,1-3H3,(H,24,29)