2-[(2E)-2-[5-(methylsulfanylperoxyamino)-4-oxidanylidene-naphthalen-1-ylidene]hydrazinyl]-5-methylsulfonyl-benzenecarbonitrile

Systemtic Name: 2-[(2E)-2-[5-(methylsulfanylperoxyamino)-4-oxidanylidene-naphthalen-1-ylidene]hydrazinyl]-5-methylsulfonyl-benzenecarbonitrile Openeye Name: 2-[(2E)-2-[5-(methylsulfanylperoxyamino)-4-oxo-1-naphthylidene]hydrazino]-5-methylsulfonyl-benzonitrile CAS Name: methanesulfenic acid [[(5E)-5-[(2-cyano-4-methylsulfonylphenyl)hydrazinylidene]-8-oxo-1-naphthalenyl]amino]oxy ester IUPAC Name: 2-[(2E)-2-[5-(methylsulfanylperoxyamino)-4-oxonaphthalen-1-ylidene]hydrazinyl]-5-methylsulfonylbenzonitrile Traditional Name: 2-[(N'E)-N'-[4-keto-5-[(methylthio)peroxyamino]-1-naphthylidene]hydrazino]-5-mesyl-benzonitrile Formula: C19H16N4O5S2 MolecularWeight: 444.48414

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Descriptors Computed from Structure

Canonical SMILES:

CSOONC1=CC=CC2=C1C(=O)C=CC2=NNC3=C(C=C(C=C3)S(=O)(=O)C)C#N

Isomeric SMILES

CSOONC1=CC=CC\2=C1C(=O)C=C/C2=N\NC3=C(C=C(C=C3)S(=O)(=O)C)C#N

InChI

InChI=1S/C19H16N4O5S2/c1-29-28-27-23-17-5-3-4-14-16(8-9-18(24)19(14)17)22-21-15-7-6-13(30(2,25)26)10-12(15)11-20/h3-10,21,23H,1-2H3/b22-16+