2-[(7-oxidanylidenecyclohepta-1,3,5-trien-1-yl)sulfanyl-phenyl-methylidene]propanedinitrile

Systemtic Name: 2-[(7-oxidanylidenecyclohepta-1,3,5-trien-1-yl)sulfanyl-phenyl-methylidene]propanedinitrile Openeye Name: 2-[(7-oxocyclohepta-1,3,5-trien-1-yl)sulfanyl-phenyl-methylene]propanedinitrile CAS Name: 2-[[(7-oxo-1-cyclohepta-1,3,5-trienyl)thio]-phenylmethylidene]propanedinitrile IUPAC Name: 2-[(7-oxocyclohepta-1,3,5-trien-1-yl)sulfanyl-phenylmethylidene]propanedinitrile Traditional Name: 2-[[(7-ketocyclohepta-1,3,5-trien-1-yl)thio]-phenyl-methylene]malononitrile Formula: C17H10N2OS MolecularWeight: 290.3391

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=C(C#N)C#N)SC2=CC=CC=CC2=O

Isomeric SMILES

C1=CC=C(C=C1)C(=C(C#N)C#N)SC2=CC=CC=CC2=O

InChI

InChI=1S/C17H10N2OS/c18-11-14(12-19)17(13-7-3-1-4-8-13)21-16-10-6-2-5-9-15(16)20/h1-10H