N-(1-adamantylmethyl)-2-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]amino]hexanamide

Systemtic Name: N-(1-adamantylmethyl)-2-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]amino]hexanamide Openeye Name: N-(1-adamantylmethyl)-2-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]hexanamide CAS Name: N-(1-adamantylmethyl)-2-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]hexanamide IUPAC Name: N-(1-adamantylmethyl)-2-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]hexanamide Traditional Name: N-(1-adamantylmethyl)-2-[(1,1-diketo-1,2-benzothiazol-3-yl)amino]hexanamide Formula: C24H33N3O3S MolecularWeight: 443.60212

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)NCC12CC3CC(C1)CC(C3)C2)NC4=NS(=O)(=O)C5=CC=CC=C54

Isomeric SMILES

CCCCC(C(=O)NCC12CC3CC(C1)CC(C3)C2)NC4=NS(=O)(=O)C5=CC=CC=C54

InChI

InChI=1S/C24H33N3O3S/c1-2-3-7-20(26-22-19-6-4-5-8-21(19)31(29,30)27-22)23(28)25-15-24-12-16-9-17(13-24)11-18(10-16)14-24/h4-6,8,16-18,20H,2-3,7,9-15H2,1H3,(H,25,28)(H,26,27)