N-[2-(4-oxidanyl-2-oxidanylidene-3H-1,3-benzothiazol-7-yl)ethyl]-6-(phenylcarbamoylamino)hexanamide

Systemtic Name: N-[2-(4-oxidanyl-2-oxidanylidene-3H-1,3-benzothiazol-7-yl)ethyl]-6-(phenylcarbamoylamino)hexanamide Openeye Name: N-[2-(4-hydroxy-2-oxo-3H-1,3-benzothiazol-7-yl)ethyl]-6-(phenylcarbamoylamino)hexanamide CAS Name: 6-[[anilino(oxo)methyl]amino]-N-[2-(4-hydroxy-2-oxo-3H-1,3-benzothiazol-7-yl)ethyl]hexanamide IUPAC Name: N-[2-(4-hydroxy-2-oxo-3H-1,3-benzothiazol-7-yl)ethyl]-6-(phenylcarbamoylamino)hexanamide Traditional Name: N-[2-(4-hydroxy-2-keto-3H-1,3-benzothiazol-7-yl)ethyl]-6-(phenylcarbamoylamino)hexanamide Formula: C22H26N4O4S MolecularWeight: 442.53124

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=O)NCCCCCC(=O)NCCC2=C3C(=C(C=C2)O)NC(=O)S3

Isomeric SMILES

C1=CC=C(C=C1)NC(=O)NCCCCCC(=O)NCCC2=C3C(=C(C=C2)O)NC(=O)S3

InChI

InChI=1S/C22H26N4O4S/c27-17-11-10-15(20-19(17)26-22(30)31-20)12-14-23-18(28)9-5-2-6-13-24-21(29)25-16-7-3-1-4-8-16/h1,3-4,7-8,10-11,27H,2,5-6,9,12-14H2,(H,23,28)(H,26,30)(H2,24,25,29)