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

Systemtic Name: N-(1H-benzimidazol-2-ylmethyl)-4-fluoranyl-3-[2-oxidanylidene-2-[4-(phenylcarbonyl)piperazin-1-yl]ethanoyl]-1H-indole-7-carboxamide Openeye Name: N-(1H-benzimidazol-2-ylmethyl)-3-[2-(4-benzoylpiperazin-1-yl)-2-oxo-acetyl]-4-fluoro-1H-indole-7-carboxamide CAS Name: N-(1H-benzimidazol-2-ylmethyl)-3-[2-(4-benzoyl-1-piperazinyl)-1,2-dioxoethyl]-4-fluoro-1H-indole-7-carboxamide IUPAC Name: N-(1H-benzimidazol-2-ylmethyl)-3-[2-(4-benzoylpiperazin-1-yl)-2-oxoacetyl]-4-fluoro-1H-indole-7-carboxamide Traditional Name: N-(1H-benzimidazol-2-ylmethyl)-3-[2-(4-benzoylpiperazino)-2-keto-acetyl]-4-fluoro-1H-indole-7-carboxamide Formula: C30H25FN6O4 MolecularWeight: 552.555703

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)NCC5=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)NCC5=NC6=CC=CC=C6N5

InChI

InChI=1S/C30H25FN6O4/c31-21-11-10-19(28(39)33-17-24-34-22-8-4-5-9-23(22)35-24)26-25(21)20(16-32-26)27(38)30(41)37-14-12-36(13-15-37)29(40)18-6-2-1-3-7-18/h1-11,16,32H,12-15,17H2,(H,33,39)(H,34,35)