N'-cyclopropyl-4-fluoranyl-3-[2-oxidanylidene-2-[4-(phenylcarbonyl)piperazin-1-yl]ethanoyl]-1H-indole-7-carboximidamide

Systemtic Name: N'-cyclopropyl-4-fluoranyl-3-[2-oxidanylidene-2-[4-(phenylcarbonyl)piperazin-1-yl]ethanoyl]-1H-indole-7-carboximidamide Openeye Name: 3-[2-(4-benzoylpiperazin-1-yl)-2-oxo-acetyl]-N'-cyclopropyl-4-fluoro-1H-indole-7-carboxamidine CAS Name: 3-[2-(4-benzoyl-1-piperazinyl)-1,2-dioxoethyl]-N'-cyclopropyl-4-fluoro-1H-indole-7-carboximidamide IUPAC Name: 3-[2-(4-benzoylpiperazin-1-yl)-2-oxoacetyl]-N'-cyclopropyl-4-fluoro-1H-indole-7-carboximidamide Traditional Name: 3-[2-(4-benzoylpiperazino)-2-keto-acetyl]-N'-cyclopropyl-4-fluoro-1H-indole-7-carboxamidine Formula: C25H24FN5O3 MolecularWeight: 461.488163

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N=C(C2=C3C(=C(C=C2)F)C(=CN3)C(=O)C(=O)N4CCN(CC4)C(=O)C5=CC=CC=C5)N

Isomeric SMILES

C1CC1N=C(C2=C3C(=C(C=C2)F)C(=CN3)C(=O)C(=O)N4CCN(CC4)C(=O)C5=CC=CC=C5)N

InChI

InChI=1S/C25H24FN5O3/c26-19-9-8-17(23(27)29-16-6-7-16)21-20(19)18(14-28-21)22(32)25(34)31-12-10-30(11-13-31)24(33)15-4-2-1-3-5-15/h1-5,8-9,14,16,28H,6-7,10-13H2,(H2,27,29)