4-tert-butyl-N-[3-methyl-1-(4-octanoylpiperazin-1-yl)-1-oxidanylidene-pentan-2-yl]benzenesulfonamide

Systemtic Name: 4-tert-butyl-N-[3-methyl-1-(4-octanoylpiperazin-1-yl)-1-oxidanylidene-pentan-2-yl]benzenesulfonamide Openeye Name: 4-tert-butyl-N-[2-methyl-1-(4-octanoylpiperazine-1-carbonyl)butyl]benzenesulfonamide CAS Name: 4-tert-butyl-N-[3-methyl-1-oxo-1-[4-(1-oxooctyl)-1-piperazinyl]pentan-2-yl]benzenesulfonamide IUPAC Name: 4-tert-butyl-N-[3-methyl-1-(4-octanoylpiperazin-1-yl)-1-oxopentan-2-yl]benzenesulfonamide Traditional Name: 4-tert-butyl-N-[1-(4-caprylylpiperazine-1-carbonyl)-2-methyl-butyl]benzenesulfonamide Formula: C28H47N3O4S MolecularWeight: 521.75548

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)N1CCN(CC1)C(=O)C(C(C)CC)NS(=O)(=O)C2=CC=C(C=C2)C(C)(C)C

Isomeric SMILES

CCCCCCCC(=O)N1CCN(CC1)C(=O)C(C(C)CC)NS(=O)(=O)C2=CC=C(C=C2)C(C)(C)C

InChI

InChI=1S/C28H47N3O4S/c1-7-9-10-11-12-13-25(32)30-18-20-31(21-19-30)27(33)26(22(3)8-2)29-36(34,35)24-16-14-23(15-17-24)28(4,5)6/h14-17,22,26,29H,7-13,18-21H2,1-6H3