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

Systemtic Name: N-(1H-benzimidazol-2-yl)-4-fluoranyl-3-[2-oxidanylidene-2-[4-(phenylcarbonyl)piperazin-1-yl]ethanoyl]-1H-indole-7-carboxamide Openeye Name: N-(1H-benzimidazol-2-yl)-3-[2-(4-benzoylpiperazin-1-yl)-2-oxo-acetyl]-4-fluoro-1H-indole-7-carboxamide CAS Name: N-(1H-benzimidazol-2-yl)-3-[2-(4-benzoyl-1-piperazinyl)-1,2-dioxoethyl]-4-fluoro-1H-indole-7-carboxamide IUPAC Name: N-(1H-benzimidazol-2-yl)-3-[2-(4-benzoylpiperazin-1-yl)-2-oxoacetyl]-4-fluoro-1H-indole-7-carboxamide Traditional Name: N-(1H-benzimidazol-2-yl)-3-[2-(4-benzoylpiperazino)-2-keto-acetyl]-4-fluoro-1H-indole-7-carboxamide Formula: C29H23FN6O4 MolecularWeight: 538.529123

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2=CC=CC=C2)C(=O)C(=O)C3=CNC4=C(C=CC(=C34)F)C(=O)NC5=NC6=CC=CC=C6N5

Isomeric SMILES

C1CN(CCN1C(=O)C2=CC=CC=C2)C(=O)C(=O)C3=CNC4=C(C=CC(=C34)F)C(=O)NC5=NC6=CC=CC=C6N5

InChI

InChI=1S/C29H23FN6O4/c30-20-11-10-18(26(38)34-29-32-21-8-4-5-9-22(21)33-29)24-23(20)19(16-31-24)25(37)28(40)36-14-12-35(13-15-36)27(39)17-6-2-1-3-7-17/h1-11,16,31H,12-15H2,(H2,32,33,34,38)