N-[(7E)-7-[(2-methoxyphenyl)hydrazinylidene]-4-[(3-octadecylsulfanyl-2-oxidanyl-naphthalen-1-yl)sulfamoyl]-8-oxidanylidene-naphthalen-1-yl]ethanamide

Systemtic Name: N-[(7E)-7-[(2-methoxyphenyl)hydrazinylidene]-4-[(3-octadecylsulfanyl-2-oxidanyl-naphthalen-1-yl)sulfamoyl]-8-oxidanylidene-naphthalen-1-yl]ethanamide Openeye Name: N-[(7E)-4-[(2-hydroxy-3-octadecylsulfanyl-1-naphthyl)sulfamoyl]-7-[(2-methoxyphenyl)hydrazono]-8-oxo-1-naphthyl]acetamide CAS Name: N-[(7E)-4-[[2-hydroxy-3-(octadecylthio)-1-naphthalenyl]sulfamoyl]-7-[(2-methoxyphenyl)hydrazinylidene]-8-oxo-1-naphthalenyl]acetamide IUPAC Name: N-[(7E)-4-[(2-hydroxy-3-octadecylsulfanylnaphthalen-1-yl)sulfamoyl]-7-[(2-methoxyphenyl)hydrazinylidene]-8-oxonaphthalen-1-yl]acetamide Traditional Name: N-[(7E)-4-[[2-hydroxy-3-(stearylthio)-1-naphthyl]sulfamoyl]-8-keto-7-[(2-methoxyphenyl)hydrazono]-1-naphthyl]acetamide Formula: C47H60N4O6S2 MolecularWeight: 841.1325

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCSC1=CC2=CC=CC=C2C(=C1O)NS(=O)(=O)C3=C4C=CC(=NNC5=CC=CC=C5OC)C(=O)C4=C(C=C3)NC(=O)C

Isomeric SMILES

CCCCCCCCCCCCCCCCCCSC1=CC2=CC=CC=C2C(=C1O)NS(=O)(=O)C3=C4C=C/C(=N\NC5=CC=CC=C5OC)/C(=O)C4=C(C=C3)NC(=O)C

InChI

InChI=1S/C47H60N4O6S2/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-23-32-58-42-33-35-24-19-20-25-36(35)45(47(42)54)51-59(55,56)43-31-30-39(48-34(2)52)44-37(43)28-29-40(46(44)53)50-49-38-26-21-22-27-41(38)57-3/h19-22,24-31,33,49,51,54H,4-18,23,32H2,1-3H3,(H,48,52)/b50-40+