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

Systemtic Name: 2-[5-[4-(4-hexoxyphenyl)-5-thiophen-2-yl-1H-pyrrol-2-yl]thiophen-2-yl]ethene-1,1,2-tricarbonitrile Openeye Name: 2-[5-[4-(4-hexoxyphenyl)-5-(2-thienyl)-1H-pyrrol-2-yl]-2-thienyl]ethene-1,1,2-tricarbonitrile CAS Name: 2-[5-[4-(4-hexoxyphenyl)-5-thiophen-2-yl-1H-pyrrol-2-yl]-2-thiophenyl]ethene-1,1,2-tricarbonitrile IUPAC Name: 2-[5-[4-(4-hexoxyphenyl)-5-thiophen-2-yl-1H-pyrrol-2-yl]thiophen-2-yl]ethene-1,1,2-tricarbonitrile Traditional Name: 2-[5-[4-(4-hexoxyphenyl)-5-(2-thienyl)-1H-pyrrol-2-yl]-2-thienyl]ethene-1,1,2-tricarbonitrile Formula: C29H24N4OS2 MolecularWeight: 508.65706

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=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

CCCCCCOC1=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/C29H24N4OS2/c1-2-3-4-5-14-34-22-10-8-20(9-11-22)23-16-25(33-29(23)28-7-6-15-35-28)27-13-12-26(36-27)24(19-32)21(17-30)18-31/h6-13,15-16,33H,2-5,14H2,1H3