2-(3-bromophenyl)-3-oxidanylidene-3-thiophen-3-yl-propanenitrile

Systemtic Name: 2-(3-bromophenyl)-3-oxidanylidene-3-thiophen-3-yl-propanenitrile Openeye Name: 2-(3-bromophenyl)-3-oxo-3-(3-thienyl)propanenitrile CAS Name: 2-(3-bromophenyl)-3-oxo-3-(3-thiophenyl)propanenitrile IUPAC Name: 2-(3-bromophenyl)-3-oxo-3-thiophen-3-ylpropanenitrile Traditional Name: 2-(3-bromophenyl)-3-keto-3-(3-thienyl)propionitrile Formula: C13H8BrNOS MolecularWeight: 306.17772

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Br)C(C#N)C(=O)C2=CSC=C2

Isomeric SMILES

C1=CC(=CC(=C1)Br)C(C#N)C(=O)C2=CSC=C2

InChI

InChI=1S/C13H8BrNOS/c14-11-3-1-2-9(6-11)12(7-15)13(16)10-4-5-17-8-10/h1-6,8,12H