5-[5-(5-cyanothiophen-2-yl)-1-dodecyl-pyrrol-2-yl]thiophene-2-carbonitrile

Systemtic Name: 5-[5-(5-cyanothiophen-2-yl)-1-dodecyl-pyrrol-2-yl]thiophene-2-carbonitrile Openeye Name: 5-[5-(5-cyano-2-thienyl)-1-dodecyl-pyrrol-2-yl]thiophene-2-carbonitrile CAS Name: 5-[5-(5-cyano-2-thiophenyl)-1-dodecyl-2-pyrrolyl]-2-thiophenecarbonitrile IUPAC Name: 5-[5-(5-cyanothiophen-2-yl)-1-dodecylpyrrol-2-yl]thiophene-2-carbonitrile Traditional Name: 5-[5-(5-cyano-2-thienyl)-1-lauryl-pyrrol-2-yl]thiophene-2-carbonitrile Formula: C26H31N3S2 MolecularWeight: 449.67444

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCN1C(=CC=C1C2=CC=C(S2)C#N)C3=CC=C(S3)C#N

Isomeric SMILES

CCCCCCCCCCCCN1C(=CC=C1C2=CC=C(S2)C#N)C3=CC=C(S3)C#N

InChI

InChI=1S/C26H31N3S2/c1-2-3-4-5-6-7-8-9-10-11-18-29-23(25-16-12-21(19-27)30-25)14-15-24(29)26-17-13-22(20-28)31-26/h12-17H,2-11,18H2,1H3