N'-[2-cyano-5-isocyano-4-(phenylsulfinyl)phenyl]-2-oxidanylidene-ethanehydrazide

Systemtic Name: N'-[2-cyano-5-isocyano-4-(phenylsulfinyl)phenyl]-2-oxidanylidene-ethanehydrazide Openeye Name: N'-[4-(benzenesulfinyl)-2-cyano-5-isocyano-phenyl]-2-oxo-acetohydrazide CAS Name: N'-[4-(benzenesulfinyl)-2-cyano-5-isocyanophenyl]-2-oxoacetohydrazide IUPAC Name: N'-[4-(benzenesulfinyl)-2-cyano-5-isocyanophenyl]-2-oxoacetohydrazide Traditional Name: N'-[4-(benzenesulfinyl)-2-cyano-5-isocyano-phenyl]-2-keto-acetohydrazide Formula: C16H10N4O3S MolecularWeight: 338.3406

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

[C-]#[N+]C1=C(C=C(C(=C1)NNC(=O)C=O)C#N)S(=O)C2=CC=CC=C2

Isomeric SMILES

[C-]#[N+]C1=C(C=C(C(=C1)NNC(=O)C=O)C#N)S(=O)C2=CC=CC=C2

InChI

InChI=1S/C16H10N4O3S/c1-18-14-8-13(19-20-16(22)10-21)11(9-17)7-15(14)24(23)12-5-3-2-4-6-12/h2-8,10,19H,(H,20,22)