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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1N2C(=O)CN(CC2(C)C(=O)NC3CCCCCCC3)S(=O)(=O)C

Isomeric SMILES

CCC1=CC=CC=C1N2C(=O)CN(CC2(C)C(=O)NC3CCCCCCC3)S(=O)(=O)C

InChI

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