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

Systemtic Name: N-[2-(4-oxidanyl-2-oxidanylidene-3H-1,3-benzothiazol-7-yl)ethyl]-6-phenylmethoxy-hexanamide Openeye Name: 6-benzyloxy-N-[2-(4-hydroxy-2-oxo-3H-1,3-benzothiazol-7-yl)ethyl]hexanamide CAS Name: N-[2-(4-hydroxy-2-oxo-3H-1,3-benzothiazol-7-yl)ethyl]-6-phenylmethoxyhexanamide IUPAC Name: N-[2-(4-hydroxy-2-oxo-3H-1,3-benzothiazol-7-yl)ethyl]-6-phenylmethoxyhexanamide Traditional Name: 6-benzoxy-N-[2-(4-hydroxy-2-keto-3H-1,3-benzothiazol-7-yl)ethyl]hexanamide Formula: C22H26N2O4S MolecularWeight: 414.51784

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H26N2O4S/c25-18-11-10-17(21-20(18)24-22(27)29-21)12-13-23-19(26)9-5-2-6-14-28-15-16-7-3-1-4-8-16/h1,3-4,7-8,10-11,25H,2,5-6,9,12-15H2,(H,23,26)(H,24,27)