2-azanyl-1-[2-[2,5-dimethyl-1-(phenylmethyl)pyrrol-3-yl]-2-oxidanylidene-ethyl]imidazole-4,5-dicarbonitrile

Systemtic Name: 2-azanyl-1-[2-[2,5-dimethyl-1-(phenylmethyl)pyrrol-3-yl]-2-oxidanylidene-ethyl]imidazole-4,5-dicarbonitrile Openeye Name: 2-amino-1-[2-(1-benzyl-2,5-dimethyl-pyrrol-3-yl)-2-oxo-ethyl]imidazole-4,5-dicarbonitrile CAS Name: 2-amino-1-[2-[2,5-dimethyl-1-(phenylmethyl)-3-pyrrolyl]-2-oxoethyl]imidazole-4,5-dicarbonitrile IUPAC Name: 2-amino-1-[2-(1-benzyl-2,5-dimethylpyrrol-3-yl)-2-oxoethyl]imidazole-4,5-dicarbonitrile Traditional Name: 2-amino-1-[2-(1-benzyl-2,5-dimethyl-pyrrol-3-yl)-2-keto-ethyl]imidazole-4,5-dicarbonitrile Formula: C20H18N6O MolecularWeight: 358.39652

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1CC2=CC=CC=C2)C)C(=O)CN3C(=C(N=C3N)C#N)C#N

Isomeric SMILES

CC1=CC(=C(N1CC2=CC=CC=C2)C)C(=O)CN3C(=C(N=C3N)C#N)C#N

InChI

InChI=1S/C20H18N6O/c1-13-8-16(14(2)25(13)11-15-6-4-3-5-7-15)19(27)12-26-18(10-22)17(9-21)24-20(26)23/h3-8H,11-12H2,1-2H3,(H2,23,24)