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

Systemtic Name: 2-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]amino]-N-(6-imidazol-1-ylpyridin-3-yl)hexanamide Openeye Name: 2-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-N-(6-imidazol-1-yl-3-pyridyl)hexanamide CAS Name: 2-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-N-[6-(1-imidazolyl)-3-pyridinyl]hexanamide IUPAC Name: 2-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-N-(6-imidazol-1-ylpyridin-3-yl)hexanamide Traditional Name: 2-[(1,1-diketo-1,2-benzothiazol-3-yl)amino]-N-(6-imidazol-1-yl-3-pyridyl)hexanamide Formula: C21H22N6O3S MolecularWeight: 438.50278

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)NC1=CN=C(C=C1)N2C=CN=C2)NC3=NS(=O)(=O)C4=CC=CC=C43

Isomeric SMILES

CCCCC(C(=O)NC1=CN=C(C=C1)N2C=CN=C2)NC3=NS(=O)(=O)C4=CC=CC=C43

InChI

InChI=1S/C21H22N6O3S/c1-2-3-7-17(25-20-16-6-4-5-8-18(16)31(29,30)26-20)21(28)24-15-9-10-19(23-13-15)27-12-11-22-14-27/h4-6,8-14,17H,2-3,7H2,1H3,(H,24,28)(H,25,26)