4-[(4-methoxyphenoxy)sulfinyl-methyl-amino]-N-oxidanyl-6-(2-phenylethynyl)quinoline-3-carboxamide

Systemtic Name: 4-[(4-methoxyphenoxy)sulfinyl-methyl-amino]-N-oxidanyl-6-(2-phenylethynyl)quinoline-3-carboxamide Openeye Name: 4-[(4-methoxyphenoxy)sulfinyl-methyl-amino]-6-(2-phenylethynyl)quinoline-3-carbohydroxamic acid CAS Name: N-hydroxy-4-[(4-methoxyphenoxy)sulfinyl-methylamino]-6-(2-phenylethynyl)-3-quinolinecarboxamide IUPAC Name: N-hydroxy-4-[(4-methoxyphenoxy)sulfinyl-methylamino]-6-(2-phenylethynyl)quinoline-3-carboxamide Traditional Name: 4-[(4-methoxyphenoxy)sulfinyl-methyl-amino]-6-(2-phenylethynyl)quinoline-3-carbohydroxamic acid Formula: C26H21N3O5S MolecularWeight: 487.52704

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=C2C=C(C=CC2=NC=C1C(=O)NO)C#CC3=CC=CC=C3)S(=O)OC4=CC=C(C=C4)OC

Isomeric SMILES

CN(C1=C2C=C(C=CC2=NC=C1C(=O)NO)C#CC3=CC=CC=C3)S(=O)OC4=CC=C(C=C4)OC

InChI

InChI=1S/C26H21N3O5S/c1-29(35(32)34-21-13-11-20(33-2)12-14-21)25-22-16-19(9-8-18-6-4-3-5-7-18)10-15-24(22)27-17-23(25)26(30)28-31/h3-7,10-17,31H,1-2H3,(H,28,30)