2-(3-bromophenyl)-3-oxidanylidene-6-thiophen-2-yl-hexanenitrile

Systemtic Name: 2-(3-bromophenyl)-3-oxidanylidene-6-thiophen-2-yl-hexanenitrile Openeye Name: 2-(3-bromophenyl)-3-oxo-6-(2-thienyl)hexanenitrile CAS Name: 2-(3-bromophenyl)-3-oxo-6-thiophen-2-ylhexanenitrile IUPAC Name: 2-(3-bromophenyl)-3-oxo-6-thiophen-2-ylhexanenitrile Traditional Name: 2-(3-bromophenyl)-3-keto-6-(2-thienyl)hexanenitrile Formula: C16H14BrNOS MolecularWeight: 348.25746

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Br)C(C#N)C(=O)CCCC2=CC=CS2

Isomeric SMILES

C1=CC(=CC(=C1)Br)C(C#N)C(=O)CCCC2=CC=CS2

InChI

InChI=1S/C16H14BrNOS/c17-13-5-1-4-12(10-13)15(11-18)16(19)8-2-6-14-7-3-9-20-14/h1,3-5,7,9-10,15H,2,6,8H2