2-[6-cyano-9-(2-cyclopropylethynyl)-1H-phenanthro[9,10-d]imidazol-2-yl]benzene-1,3-dicarbonitrile

Systemtic Name: 2-[6-cyano-9-(2-cyclopropylethynyl)-1H-phenanthro[9,10-d]imidazol-2-yl]benzene-1,3-dicarbonitrile Openeye Name: 2-[6-cyano-9-(2-cyclopropylethynyl)-1H-phenanthro[9,10-d]imidazol-2-yl]benzene-1,3-dicarbonitrile CAS Name: 2-[6-cyano-9-(2-cyclopropylethynyl)-1H-phenanthro[9,10-d]imidazol-2-yl]benzene-1,3-dicarbonitrile IUPAC Name: 2-[6-cyano-9-(2-cyclopropylethynyl)-1H-phenanthro[9,10-d]imidazol-2-yl]benzene-1,3-dicarbonitrile Traditional Name: 2-[6-cyano-9-(2-cyclopropylethynyl)-1H-phenanthr[9,10-d]imidazol-2-yl]isophthalonitrile Formula: C29H15N5 MolecularWeight: 433.4629

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C#CC2=CC3=C(C=C2)C4=C(C5=C3C=C(C=C5)C#N)N=C(N4)C6=C(C=CC=C6C#N)C#N

Isomeric SMILES

C1CC1C#CC2=CC3=C(C=C2)C4=C(C5=C3C=C(C=C5)C#N)N=C(N4)C6=C(C=CC=C6C#N)C#N

InChI

InChI=1S/C29H15N5/c30-14-19-9-11-23-25(13-19)24-12-18(7-6-17-4-5-17)8-10-22(24)27-28(23)34-29(33-27)26-20(15-31)2-1-3-21(26)16-32/h1-3,8-13,17H,4-5H2,(H,33,34)