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

Systemtic Name: 6-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]amino]-N-(2-iodanylphenyl)hexanamide Openeye Name: 6-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-N-(2-iodophenyl)hexanamide CAS Name: 6-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-N-(2-iodophenyl)hexanamide IUPAC Name: 6-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-N-(2-iodophenyl)hexanamide Traditional Name: 6-[(1,1-diketo-1,2-benzothiazol-3-yl)amino]-N-(2-iodophenyl)hexanamide Formula: C19H20IN3O3S MolecularWeight: 497.34987

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NS2(=O)=O)NCCCCCC(=O)NC3=CC=CC=C3I

Isomeric SMILES

C1=CC=C2C(=C1)C(=NS2(=O)=O)NCCCCCC(=O)NC3=CC=CC=C3I

InChI

InChI=1S/C19H20IN3O3S/c20-15-9-4-5-10-16(15)22-18(24)12-2-1-7-13-21-19-14-8-3-6-11-17(14)27(25,26)23-19/h3-6,8-11H,1-2,7,12-13H2,(H,21,23)(H,22,24)