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

Systemtic Name: 6-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]amino]-N-(3-bromophenyl)hexanamide Openeye Name: N-(3-bromophenyl)-6-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]hexanamide CAS Name: N-(3-bromophenyl)-6-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]hexanamide IUPAC Name: N-(3-bromophenyl)-6-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]hexanamide Traditional Name: N-(3-bromophenyl)-6-[(1,1-diketo-1,2-benzothiazol-3-yl)amino]hexanamide Formula: C19H20BrN3O3S MolecularWeight: 450.3494

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NS2(=O)=O)NCCCCCC(=O)NC3=CC(=CC=C3)Br

Isomeric SMILES

C1=CC=C2C(=C1)C(=NS2(=O)=O)NCCCCCC(=O)NC3=CC(=CC=C3)Br

InChI

InChI=1S/C19H20BrN3O3S/c20-14-7-6-8-15(13-14)22-18(24)11-2-1-5-12-21-19-16-9-3-4-10-17(16)27(25,26)23-19/h3-4,6-10,13H,1-2,5,11-12H2,(H,21,23)(H,22,24)