4-[(E)-3-(5-bromanylthiophen-2-yl)-3-oxidanylidene-prop-1-enyl]benzenecarbonitrile

Systemtic Name: 4-[(E)-3-(5-bromanylthiophen-2-yl)-3-oxidanylidene-prop-1-enyl]benzenecarbonitrile Openeye Name: 4-[(E)-3-(5-bromo-2-thienyl)-3-oxo-prop-1-enyl]benzonitrile CAS Name: 4-[(E)-3-(5-bromo-2-thiophenyl)-3-oxoprop-1-enyl]benzonitrile IUPAC Name: 4-[(E)-3-(5-bromothiophen-2-yl)-3-oxoprop-1-enyl]benzonitrile Traditional Name: 4-[(E)-3-(5-bromo-2-thienyl)-3-keto-prop-1-enyl]benzonitrile Formula: C14H8BrNOS MolecularWeight: 318.18842

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C=CC(=O)C2=CC=C(S2)Br)C#N

Isomeric SMILES

C1=CC(=CC=C1/C=C/C(=O)C2=CC=C(S2)Br)C#N

InChI

InChI=1S/C14H8BrNOS/c15-14-8-7-13(18-14)12(17)6-5-10-1-3-11(9-16)4-2-10/h1-8H/b6-5+