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

Systemtic Name: N-(3-acetamidophenyl)-2-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]amino]hexanamide Openeye Name: N-(3-acetamidophenyl)-2-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]hexanamide CAS Name: N-(3-acetamidophenyl)-2-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]hexanamide IUPAC Name: N-(3-acetamidophenyl)-2-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]hexanamide Traditional Name: N-(3-acetamidophenyl)-2-[(1,1-diketo-1,2-benzothiazol-3-yl)amino]hexanamide Formula: C21H24N4O4S MolecularWeight: 428.50466

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)NC1=CC=CC(=C1)NC(=O)C)NC2=NS(=O)(=O)C3=CC=CC=C32

Isomeric SMILES

CCCCC(C(=O)NC1=CC=CC(=C1)NC(=O)C)NC2=NS(=O)(=O)C3=CC=CC=C32

InChI

InChI=1S/C21H24N4O4S/c1-3-4-11-18(21(27)23-16-9-7-8-15(13-16)22-14(2)26)24-20-17-10-5-6-12-19(17)30(28,29)25-20/h5-10,12-13,18H,3-4,11H2,1-2H3,(H,22,26)(H,23,27)(H,24,25)