2-[1-(4-bromophenyl)-3-oxidanylidene-3-thiophen-2-yl-propyl]propanedinitrile

Systemtic Name: 2-[1-(4-bromophenyl)-3-oxidanylidene-3-thiophen-2-yl-propyl]propanedinitrile Openeye Name: 2-[1-(4-bromophenyl)-3-oxo-3-(2-thienyl)propyl]propanedinitrile CAS Name: 2-[1-(4-bromophenyl)-3-oxo-3-thiophen-2-ylpropyl]propanedinitrile IUPAC Name: 2-[1-(4-bromophenyl)-3-oxo-3-thiophen-2-ylpropyl]propanedinitrile Traditional Name: 2-[1-(4-bromophenyl)-3-keto-3-(2-thienyl)propyl]malononitrile Formula: C16H11BrN2OS MolecularWeight: 359.24034

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H11BrN2OS/c17-13-5-3-11(4-6-13)14(12(9-18)10-19)8-15(20)16-2-1-7-21-16/h1-7,12,14H,8H2