3-(5-bromanylthiophen-2-yl)-2-(2-methoxy-5-methyl-phenyl)-3-oxidanylidene-propanenitrile

Systemtic Name: 3-(5-bromanylthiophen-2-yl)-2-(2-methoxy-5-methyl-phenyl)-3-oxidanylidene-propanenitrile Openeye Name: 3-(5-bromo-2-thienyl)-2-(2-methoxy-5-methyl-phenyl)-3-oxo-propanenitrile CAS Name: 3-(5-bromo-2-thiophenyl)-2-(2-methoxy-5-methylphenyl)-3-oxopropanenitrile IUPAC Name: 3-(5-bromothiophen-2-yl)-2-(2-methoxy-5-methylphenyl)-3-oxopropanenitrile Traditional Name: 3-(5-bromo-2-thienyl)-3-keto-2-(2-methoxy-5-methyl-phenyl)propionitrile Formula: C15H12BrNO2S MolecularWeight: 350.23028

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)C(C#N)C(=O)C2=CC=C(S2)Br

Isomeric SMILES

CC1=CC(=C(C=C1)OC)C(C#N)C(=O)C2=CC=C(S2)Br

InChI

InChI=1S/C15H12BrNO2S/c1-9-3-4-12(19-2)10(7-9)11(8-17)15(18)13-5-6-14(16)20-13/h3-7,11H,1-2H3