5-(3-iodanyl-1-thiophen-2-yl-propyl)-6-oxidanylidene-cyclohexa-1,3-diene-1-carbonitrile

Systemtic Name: 5-(3-iodanyl-1-thiophen-2-yl-propyl)-6-oxidanylidene-cyclohexa-1,3-diene-1-carbonitrile Openeye Name: 5-[3-iodo-1-(2-thienyl)propyl]-6-oxo-cyclohexa-1,3-diene-1-carbonitrile CAS Name: 5-(3-iodo-1-thiophen-2-ylpropyl)-6-oxo-1-cyclohexa-1,3-dienecarbonitrile IUPAC Name: 5-(3-iodo-1-thiophen-2-ylpropyl)-6-oxocyclohexa-1,3-diene-1-carbonitrile Traditional Name: 5-[3-iodo-1-(2-thienyl)propyl]-6-keto-cyclohexa-1,3-diene-1-carbonitrile Formula: C14H12INOS MolecularWeight: 369.22065

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(C(=O)C(=C1)C#N)C(CCI)C2=CC=CS2

Isomeric SMILES

C1=CC(C(=O)C(=C1)C#N)C(CCI)C2=CC=CS2

InChI

InChI=1S/C14H12INOS/c15-7-6-11(13-5-2-8-18-13)12-4-1-3-10(9-16)14(12)17/h1-5,8,11-12H,6-7H2