1-[2-[5-(1,3-benzothiazol-2-ylamino)naphthalen-1-yl]oxyethanoylamino]propyl-ethoxy-phosphinic acid

Systemtic Name: 1-[2-[5-(1,3-benzothiazol-2-ylamino)naphthalen-1-yl]oxyethanoylamino]propyl-ethoxy-phosphinic acid Openeye Name: 1-[[2-[[5-(1,3-benzothiazol-2-ylamino)-1-naphthyl]oxy]acetyl]amino]propyl-ethoxy-phosphinic acid CAS Name: 1-[[2-[[5-(1,3-benzothiazol-2-ylamino)-1-naphthalenyl]oxy]-1-oxoethyl]amino]propyl-ethoxyphosphinic acid IUPAC Name: 1-[[2-[5-(1,3-benzothiazol-2-ylamino)naphthalen-1-yl]oxyacetyl]amino]propyl-ethoxyphosphinic acid Traditional Name: 1-[[2-[5-(1,3-benzothiazol-2-ylamino)-1-naphthoxy]acetyl]amino]propyl-ethoxy-phosphinic acid Formula: C24H26N3O5PS MolecularWeight: 499.519101

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Descriptors Computed from Structure

Canonical SMILES:

CCC(NC(=O)COC1=CC=CC2=C1C=CC=C2NC3=NC4=CC=CC=C4S3)P(=O)(O)OCC

Isomeric SMILES

CCC(NC(=O)COC1=CC=CC2=C1C=CC=C2NC3=NC4=CC=CC=C4S3)P(=O)(O)OCC

InChI

InChI=1S/C24H26N3O5PS/c1-3-23(33(29,30)32-4-2)27-22(28)15-31-20-13-8-9-16-17(20)10-7-12-18(16)25-24-26-19-11-5-6-14-21(19)34-24/h5-14,23H,3-4,15H2,1-2H3,(H,25,26)(H,27,28)(H,29,30)