6-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]amino]-N-(4-iodophenyl)hexanamide

Systemtic Name: 6-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]amino]-N-(4-iodophenyl)hexanamide Openeye Name: 6-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-N-(4-iodophenyl)hexanamide CAS Name: 6-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-N-(4-iodophenyl)hexanamide IUPAC Name: 6-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-N-(4-iodophenyl)hexanamide Traditional Name: 6-[(1,1-diketo-1,2-benzothiazol-3-yl)amino]-N-(4-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=C(C=C3)I

Isomeric SMILES

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

InChI

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