N-(2,6-dimethylpyrimidin-4-yl)-4-fluoranyl-3-[2-oxidanylidene-2-[4-(phenylcarbonyl)piperazin-1-yl]ethanoyl]-1H-indole-7-carboxamide

Systemtic Name: N-(2,6-dimethylpyrimidin-4-yl)-4-fluoranyl-3-[2-oxidanylidene-2-[4-(phenylcarbonyl)piperazin-1-yl]ethanoyl]-1H-indole-7-carboxamide Openeye Name: 3-[2-(4-benzoylpiperazin-1-yl)-2-oxo-acetyl]-N-(2,6-dimethylpyrimidin-4-yl)-4-fluoro-1H-indole-7-carboxamide CAS Name: 3-[2-(4-benzoyl-1-piperazinyl)-1,2-dioxoethyl]-N-(2,6-dimethyl-4-pyrimidinyl)-4-fluoro-1H-indole-7-carboxamide IUPAC Name: 3-[2-(4-benzoylpiperazin-1-yl)-2-oxoacetyl]-N-(2,6-dimethylpyrimidin-4-yl)-4-fluoro-1H-indole-7-carboxamide Traditional Name: 3-[2-(4-benzoylpiperazino)-2-keto-acetyl]-N-(2,6-dimethylpyrimidin-4-yl)-4-fluoro-1H-indole-7-carboxamide Formula: C28H25FN6O4 MolecularWeight: 528.534303

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)C)NC(=O)C2=C3C(=C(C=C2)F)C(=CN3)C(=O)C(=O)N4CCN(CC4)C(=O)C5=CC=CC=C5

Isomeric SMILES

CC1=CC(=NC(=N1)C)NC(=O)C2=C3C(=C(C=C2)F)C(=CN3)C(=O)C(=O)N4CCN(CC4)C(=O)C5=CC=CC=C5

InChI

InChI=1S/C28H25FN6O4/c1-16-14-22(32-17(2)31-16)33-26(37)19-8-9-21(29)23-20(15-30-24(19)23)25(36)28(39)35-12-10-34(11-13-35)27(38)18-6-4-3-5-7-18/h3-9,14-15,30H,10-13H2,1-2H3,(H,31,32,33,37)