2-(5-bromanyl-4-dodecyl-thiophen-2-yl)thiophene-3-carbonitrile

Systemtic Name: 2-(5-bromanyl-4-dodecyl-thiophen-2-yl)thiophene-3-carbonitrile Openeye Name: 2-(5-bromo-4-dodecyl-2-thienyl)thiophene-3-carbonitrile CAS Name: 2-(5-bromo-4-dodecyl-2-thiophenyl)-3-thiophenecarbonitrile IUPAC Name: 2-(5-bromo-4-dodecylthiophen-2-yl)thiophene-3-carbonitrile Traditional Name: 2-(5-bromo-4-lauryl-2-thienyl)thiophene-3-carbonitrile Formula: C21H28BrNS2 MolecularWeight: 438.48772

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1=C(SC(=C1)C2=C(C=CS2)C#N)Br

Isomeric SMILES

CCCCCCCCCCCCC1=C(SC(=C1)C2=C(C=CS2)C#N)Br

InChI

InChI=1S/C21H28BrNS2/c1-2-3-4-5-6-7-8-9-10-11-12-17-15-19(25-21(17)22)20-18(16-23)13-14-24-20/h13-15H,2-12H2,1H3