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

Systemtic Name: 6-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]amino]-N-(2-prop-2-enylsulfanylphenyl)hexanamide Openeye Name: N-(2-allylsulfanylphenyl)-6-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]hexanamide CAS Name: 6-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-N-[2-(prop-2-enylthio)phenyl]hexanamide IUPAC Name: 6-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-N-(2-prop-2-enylsulfanylphenyl)hexanamide Traditional Name: N-[2-(allylthio)phenyl]-6-[(1,1-diketo-1,2-benzothiazol-3-yl)amino]hexanamide Formula: C22H25N3O3S2 MolecularWeight: 443.5822

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Descriptors Computed from Structure

Canonical SMILES:

C=CCSC1=CC=CC=C1NC(=O)CCCCCNC2=NS(=O)(=O)C3=CC=CC=C32

Isomeric SMILES

C=CCSC1=CC=CC=C1NC(=O)CCCCCNC2=NS(=O)(=O)C3=CC=CC=C32

InChI

InChI=1S/C22H25N3O3S2/c1-2-16-29-19-12-7-6-11-18(19)24-21(26)14-4-3-9-15-23-22-17-10-5-8-13-20(17)30(27,28)25-22/h2,5-8,10-13H,1,3-4,9,14-16H2,(H,23,25)(H,24,26)