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

Systemtic Name: 2-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]amino]-N-butyl-hexanamide Openeye Name: N-butyl-2-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]hexanamide CAS Name: N-butyl-2-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]hexanamide IUPAC Name: N-butyl-2-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]hexanamide Traditional Name: N-butyl-2-[(1,1-diketo-1,2-benzothiazol-3-yl)amino]hexanamide Formula: C17H25N3O3S MolecularWeight: 351.4637

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)NCCCC)NC1=NS(=O)(=O)C2=CC=CC=C21

Isomeric SMILES

CCCCC(C(=O)NCCCC)NC1=NS(=O)(=O)C2=CC=CC=C21

InChI

InChI=1S/C17H25N3O3S/c1-3-5-10-14(17(21)18-12-6-4-2)19-16-13-9-7-8-11-15(13)24(22,23)20-16/h7-9,11,14H,3-6,10,12H2,1-2H3,(H,18,21)(H,19,20)