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

Systemtic Name: 6-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]amino]-N-(4-butylphenyl)hexanamide Openeye Name: N-(4-butylphenyl)-6-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]hexanamide CAS Name: N-(4-butylphenyl)-6-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]hexanamide IUPAC Name: N-(4-butylphenyl)-6-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]hexanamide Traditional Name: N-(4-butylphenyl)-6-[(1,1-diketo-1,2-benzothiazol-3-yl)amino]hexanamide Formula: C23H29N3O3S MolecularWeight: 427.55966

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=O)CCCCCNC2=NS(=O)(=O)C3=CC=CC=C32

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=O)CCCCCNC2=NS(=O)(=O)C3=CC=CC=C32

InChI

InChI=1S/C23H29N3O3S/c1-2-3-9-18-13-15-19(16-14-18)25-22(27)12-5-4-8-17-24-23-20-10-6-7-11-21(20)30(28,29)26-23/h6-7,10-11,13-16H,2-5,8-9,12,17H2,1H3,(H,24,26)(H,25,27)