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

Systemtic Name: 4-[1-(4-azanylbutyl)indol-3-yl]-3-(1-methylindol-3-yl)-2-oxidanylidene-1H-imidazole-5-carbonitrile; ethanoyl fluoride Openeye Name: acetyl fluoride; 4-[1-(4-aminobutyl)indol-3-yl]-3-(1-methylindol-3-yl)-2-oxo-1H-imidazole-5-carbonitrile CAS Name: acetyl fluoride; 4-[1-(4-aminobutyl)-3-indolyl]-3-(1-methyl-3-indolyl)-2-oxo-1H-imidazole-5-carbonitrile IUPAC Name: acetyl fluoride; 4-[1-(4-aminobutyl)indol-3-yl]-3-(1-methylindol-3-yl)-2-oxo-1H-imidazole-5-carbonitrile Traditional Name: acetyl fluoride; 5-[1-(4-aminobutyl)indol-3-yl]-2-keto-1-(1-methylindol-3-yl)-4-imidazoline-4-carbonitrile Formula: C31H33F3N6O4 MolecularWeight: 610.62673

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)F.CC(=O)F.CC(=O)F.CN1C=C(C2=CC=CC=C21)N3C(=C(NC3=O)C#N)C4=CN(C5=CC=CC=C54)CCCCN

Isomeric SMILES

CC(=O)F.CC(=O)F.CC(=O)F.CN1C=C(C2=CC=CC=C21)N3C(=C(NC3=O)C#N)C4=CN(C5=CC=CC=C54)CCCCN

InChI

InChI=1S/C25H24N6O.3C2H3FO/c1-29-16-23(18-9-3-4-10-21(18)29)31-24(20(14-27)28-25(31)32)19-15-30(13-7-6-12-26)22-11-5-2-8-17(19)22;3*1-2(3)4/h2-5,8-11,15-16H,6-7,12-13,26H2,1H3,(H,28,32);3*1H3