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

Systemtic Name: N-cyclooctyl-2-methyl-4-methylsulfonyl-6-oxidanylidene-1-(2-thiophen-2-ylethyl)piperazine-2-carboxamide Openeye Name: N-cyclooctyl-2-methyl-4-methylsulfonyl-6-oxo-1-[2-(2-thienyl)ethyl]piperazine-2-carboxamide CAS Name: N-cyclooctyl-2-methyl-4-methylsulfonyl-6-oxo-1-(2-thiophen-2-ylethyl)-2-piperazinecarboxamide IUPAC Name: N-cyclooctyl-2-methyl-4-methylsulfonyl-6-oxo-1-(2-thiophen-2-ylethyl)piperazine-2-carboxamide Traditional Name: N-cyclooctyl-6-keto-4-mesyl-2-methyl-1-[2-(2-thienyl)ethyl]piperazine-2-carboxamide Formula: C21H33N3O4S2 MolecularWeight: 455.63442

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CN(CC(=O)N1CCC2=CC=CS2)S(=O)(=O)C)C(=O)NC3CCCCCCC3

Isomeric SMILES

CC1(CN(CC(=O)N1CCC2=CC=CS2)S(=O)(=O)C)C(=O)NC3CCCCCCC3

InChI

InChI=1S/C21H33N3O4S2/c1-21(20(26)22-17-9-6-4-3-5-7-10-17)16-23(30(2,27)28)15-19(25)24(21)13-12-18-11-8-14-29-18/h8,11,14,17H,3-7,9-10,12-13,15-16H2,1-2H3,(H,22,26)