N-(1H-benzimidazol-2-yl)-6-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]amino]hexanamide

Systemtic Name: N-(1H-benzimidazol-2-yl)-6-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]amino]hexanamide Openeye Name: N-(1H-benzimidazol-2-yl)-6-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]hexanamide CAS Name: N-(1H-benzimidazol-2-yl)-6-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]hexanamide IUPAC Name: N-(1H-benzimidazol-2-yl)-6-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]hexanamide Traditional Name: N-(1H-benzimidazol-2-yl)-6-[(1,1-diketo-1,2-benzothiazol-3-yl)amino]hexanamide Formula: C20H21N5O3S MolecularWeight: 411.47744

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NS2(=O)=O)NCCCCCC(=O)NC3=NC4=CC=CC=C4N3

Isomeric SMILES

C1=CC=C2C(=C1)C(=NS2(=O)=O)NCCCCCC(=O)NC3=NC4=CC=CC=C4N3

InChI

InChI=1S/C20H21N5O3S/c26-18(24-20-22-15-9-4-5-10-16(15)23-20)12-2-1-7-13-21-19-14-8-3-6-11-17(14)29(27,28)25-19/h3-6,8-11H,1-2,7,12-13H2,(H,21,25)(H2,22,23,24,26)