N-(3-azanylidene-1H-isoindol-2-yl)-4-(2,5-dimethylpyrrol-1-yl)benzamide hydrobromide

Systemtic Name: N-(3-azanylidene-1H-isoindol-2-yl)-4-(2,5-dimethylpyrrol-1-yl)benzamide hydrobromide Openeye Name: 4-(2,5-dimethylpyrrol-1-yl)-N-(1-iminoisoindolin-2-yl)benzamide hydrobromide CAS Name: 4-(2,5-dimethyl-1-pyrrolyl)-N-(3-imino-1H-isoindol-2-yl)benzamide hydrobromide IUPAC Name: 4-(2,5-dimethylpyrrol-1-yl)-N-(3-imino-1H-isoindol-2-yl)benzamide hydrobromide Traditional Name: 4-(2,5-dimethylpyrrol-1-yl)-N-(1-iminoisoindolin-2-yl)benzamide hydrobromide Formula: C21H21BrN4O MolecularWeight: 425.32164

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(N1C2=CC=C(C=C2)C(=O)NN3CC4=CC=CC=C4C3=N)C.Br

Isomeric SMILES

CC1=CC=C(N1C2=CC=C(C=C2)C(=O)NN3CC4=CC=CC=C4C3=N)C.Br

InChI

InChI=1S/C21H20N4O.BrH/c1-14-7-8-15(2)25(14)18-11-9-16(10-12-18)21(26)23-24-13-17-5-3-4-6-19(17)20(24)22;/h3-12,22H,13H2,1-2H3,(H,23,26);1H