5-[3-[5-cyano-3-(1H-indol-3-yl)-2-oxidanylidene-1H-imidazol-4-yl]indol-1-yl]pentanimidamide; ethanoyl fluoride

Systemtic Name: 5-[3-[5-cyano-3-(1H-indol-3-yl)-2-oxidanylidene-1H-imidazol-4-yl]indol-1-yl]pentanimidamide; ethanoyl fluoride Openeye Name: acetyl fluoride; 5-[3-[5-cyano-3-(1H-indol-3-yl)-2-oxo-1H-imidazol-4-yl]indol-1-yl]pentanamidine CAS Name: acetyl fluoride; 5-[3-[5-cyano-3-(1H-indol-3-yl)-2-oxo-1H-imidazol-4-yl]-1-indolyl]pentanimidamide IUPAC Name: acetyl fluoride; 5-[3-[5-cyano-3-(1H-indol-3-yl)-2-oxo-1H-imidazol-4-yl]indol-1-yl]pentanimidamide Traditional Name: acetyl fluoride; 5-[3-[5-cyano-3-(1H-indol-3-yl)-2-keto-4-imidazolin-4-yl]indol-1-yl]valeramidine Formula: C31H32F3N7O4 MolecularWeight: 623.62549

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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)CCCCC(=N)N

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)CCCCC(=N)N

InChI

InChI=1S/C25H23N7O.3C2H3FO/c26-13-20-24(32(25(33)30-20)22-14-29-19-9-3-1-8-17(19)22)18-15-31(12-6-5-11-23(27)28)21-10-4-2-7-16(18)21;3*1-2(3)4/h1-4,7-10,14-15,29H,5-6,11-12H2,(H3,27,28)(H,30,33);3*1H3