1-[[6-(1,3-benzothiazol-2-ylamino)-2-oxidanylidene-chromen-3-yl]carbonylamino]butan-2-yl-ethoxy-phosphinic acid

Systemtic Name: 1-[[6-(1,3-benzothiazol-2-ylamino)-2-oxidanylidene-chromen-3-yl]carbonylamino]butan-2-yl-ethoxy-phosphinic acid Openeye Name: 1-[[[6-(1,3-benzothiazol-2-ylamino)-2-oxo-chromene-3-carbonyl]amino]methyl]propyl-ethoxy-phosphinic acid CAS Name: 1-[[[6-(1,3-benzothiazol-2-ylamino)-2-oxo-1-benzopyran-3-yl]-oxomethyl]amino]butan-2-yl-ethoxyphosphinic acid IUPAC Name: 1-[[6-(1,3-benzothiazol-2-ylamino)-2-oxochromene-3-carbonyl]amino]butan-2-yl-ethoxyphosphinic acid Traditional Name: 1-[[[6-(1,3-benzothiazol-2-ylamino)-2-keto-chromene-3-carbonyl]amino]methyl]propyl-ethoxy-phosphinic acid Formula: C23H24N3O6PS MolecularWeight: 501.491921

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CNC(=O)C1=CC2=C(C=CC(=C2)NC3=NC4=CC=CC=C4S3)OC1=O)P(=O)(O)OCC

Isomeric SMILES

CCC(CNC(=O)C1=CC2=C(C=CC(=C2)NC3=NC4=CC=CC=C4S3)OC1=O)P(=O)(O)OCC

InChI

InChI=1S/C23H24N3O6PS/c1-3-16(33(29,30)31-4-2)13-24-21(27)17-12-14-11-15(9-10-19(14)32-22(17)28)25-23-26-18-7-5-6-8-20(18)34-23/h5-12,16H,3-4,13H2,1-2H3,(H,24,27)(H,25,26)(H,29,30)