2-[5-[4-(4-butylphenyl)-5-thiophen-2-yl-1H-pyrrol-2-yl]thiophen-2-yl]ethene-1,1,2-tricarbonitrile

Systemtic Name: 2-[5-[4-(4-butylphenyl)-5-thiophen-2-yl-1H-pyrrol-2-yl]thiophen-2-yl]ethene-1,1,2-tricarbonitrile Openeye Name: 2-[5-[4-(4-butylphenyl)-5-(2-thienyl)-1H-pyrrol-2-yl]-2-thienyl]ethene-1,1,2-tricarbonitrile CAS Name: 2-[5-[4-(4-butylphenyl)-5-thiophen-2-yl-1H-pyrrol-2-yl]-2-thiophenyl]ethene-1,1,2-tricarbonitrile IUPAC Name: 2-[5-[4-(4-butylphenyl)-5-thiophen-2-yl-1H-pyrrol-2-yl]thiophen-2-yl]ethene-1,1,2-tricarbonitrile Traditional Name: 2-[5-[4-(4-butylphenyl)-5-(2-thienyl)-1H-pyrrol-2-yl]-2-thienyl]ethene-1,1,2-tricarbonitrile Formula: C27H20N4S2 MolecularWeight: 464.6045

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C2=C(NC(=C2)C3=CC=C(S3)C(=C(C#N)C#N)C#N)C4=CC=CS4

Isomeric SMILES

CCCCC1=CC=C(C=C1)C2=C(NC(=C2)C3=CC=C(S3)C(=C(C#N)C#N)C#N)C4=CC=CS4

InChI

InChI=1S/C27H20N4S2/c1-2-3-5-18-7-9-19(10-8-18)21-14-23(31-27(21)26-6-4-13-32-26)25-12-11-24(33-25)22(17-30)20(15-28)16-29/h4,6-14,31H,2-3,5H2,1H3