4-[1-(3-azanylpropyl)indol-3-yl]-3-(1H-indol-3-yl)-2-oxidanylidene-1H-imidazole-5-carbonitrile; ethanoyl fluoride

Systemtic Name: 4-[1-(3-azanylpropyl)indol-3-yl]-3-(1H-indol-3-yl)-2-oxidanylidene-1H-imidazole-5-carbonitrile; ethanoyl fluoride Openeye Name: acetyl fluoride; 4-[1-(3-aminopropyl)indol-3-yl]-3-(1H-indol-3-yl)-2-oxo-1H-imidazole-5-carbonitrile CAS Name: acetyl fluoride; 4-[1-(3-aminopropyl)-3-indolyl]-3-(1H-indol-3-yl)-2-oxo-1H-imidazole-5-carbonitrile IUPAC Name: acetyl fluoride; 4-[1-(3-aminopropyl)indol-3-yl]-3-(1H-indol-3-yl)-2-oxo-1H-imidazole-5-carbonitrile Traditional Name: acetyl fluoride; 5-[1-(3-aminopropyl)indol-3-yl]-1-(1H-indol-3-yl)-2-keto-4-imidazoline-4-carbonitrile Formula: C29H29F3N6O4 MolecularWeight: 582.57357

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)F.CC(=O)F.CC(=O)F.C1=CC=C2C(=C1)C(=CN2)N3C(=C(NC3=O)C#N)C4=CN(C5=CC=CC=C54)CCCN

Isomeric SMILES

CC(=O)F.CC(=O)F.CC(=O)F.C1=CC=C2C(=C1)C(=CN2)N3C(=C(NC3=O)C#N)C4=CN(C5=CC=CC=C54)CCCN

InChI

InChI=1S/C23H20N6O.3C2H3FO/c24-10-5-11-28-14-17(15-6-2-4-9-20(15)28)22-19(12-25)27-23(30)29(22)21-13-26-18-8-3-1-7-16(18)21;3*1-2(3)4/h1-4,6-9,13-14,26H,5,10-11,24H2,(H,27,30);3*1H3