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

Systemtic Name: N-cyclooctyl-1-(2,3-dimethylphenyl)-2-methyl-4-methylsulfonyl-6-oxidanylidene-piperazine-2-carboxamide Openeye Name: N-cyclooctyl-1-(2,3-dimethylphenyl)-2-methyl-4-methylsulfonyl-6-oxo-piperazine-2-carboxamide CAS Name: N-cyclooctyl-1-(2,3-dimethylphenyl)-2-methyl-4-methylsulfonyl-6-oxo-2-piperazinecarboxamide IUPAC Name: N-cyclooctyl-1-(2,3-dimethylphenyl)-2-methyl-4-methylsulfonyl-6-oxopiperazine-2-carboxamide Traditional Name: N-cyclooctyl-1-(2,3-dimethylphenyl)-6-keto-4-mesyl-2-methyl-piperazine-2-carboxamide Formula: C23H35N3O4S MolecularWeight: 449.6067

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N2C(=O)CN(CC2(C)C(=O)NC3CCCCCCC3)S(=O)(=O)C)C

Isomeric SMILES

CC1=C(C(=CC=C1)N2C(=O)CN(CC2(C)C(=O)NC3CCCCCCC3)S(=O)(=O)C)C

InChI

InChI=1S/C23H35N3O4S/c1-17-11-10-14-20(18(17)2)26-21(27)15-25(31(4,29)30)16-23(26,3)22(28)24-19-12-8-6-5-7-9-13-19/h10-11,14,19H,5-9,12-13,15-16H2,1-4H3,(H,24,28)