2-[7-cyano-4-phenyl-5-(phenylmethyl)pyrrolo[3,2-d]pyrimidin-6-yl]ethenyl-dimethyl-azanium

Systemtic Name: 2-[7-cyano-4-phenyl-5-(phenylmethyl)pyrrolo[3,2-d]pyrimidin-6-yl]ethenyl-dimethyl-azanium Openeye Name: 2-(5-benzyl-7-cyano-4-phenyl-pyrrolo[3,2-d]pyrimidin-6-yl)vinyl-dimethyl-ammonium CAS Name: 2-[7-cyano-4-phenyl-5-(phenylmethyl)-6-pyrrolo[3,2-d]pyrimidinyl]ethenyl-dimethylammonium IUPAC Name: 2-(5-benzyl-7-cyano-4-phenylpyrrolo[3,2-d]pyrimidin-6-yl)ethenyl-dimethylazanium Traditional Name: 2-(5-benzyl-7-cyano-4-phenyl-pyrrolo[3,2-d]pyrimidin-6-yl)vinyl-dimethyl-ammonium Formula: C24H22N5+ MolecularWeight: 380.46498

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)C=CC1=C(C2=C(N1CC3=CC=CC=C3)C(=NC=N2)C4=CC=CC=C4)C#N

Isomeric SMILES

C[NH+](C)C=CC1=C(C2=C(N1CC3=CC=CC=C3)C(=NC=N2)C4=CC=CC=C4)C#N

InChI

InChI=1S/C24H21N5/c1-28(2)14-13-21-20(15-25)23-24(29(21)16-18-9-5-3-6-10-18)22(26-17-27-23)19-11-7-4-8-12-19/h3-14,17H,16H2,1-2H3/p+1